#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hyh s TYR 55 N 0.00 2.02 -0.51 3.10 1.51 -1.23 -4.96 117.35 117.29 3hyh s TYR 55 Ca 0.00 -0.97 -0.11 0.00 -1.01 0.00 0.00 57.07 54.97 3hyh s TYR 55 Cb 0.00 -1.44 0.01 0.00 -0.11 0.00 0.00 41.96 40.42 3hyh s TYR 55 CO 0.00 0.09 0.62 1.04 -1.11 0.00 0.00 175.55 176.19 3hyh n GLN 56 N -0.94 -2.08 -1.86 -0.62 6.02 -1.26 -1.86 117.38 114.78 3hyh n GLN 56 Ca -0.08 1.94 -0.42 0.00 -0.01 0.00 0.00 57.00 58.43 3hyh n GLN 56 Cb 0.66 -5.68 -0.03 0.00 1.02 0.00 0.00 30.24 26.22 3hyh n GLN 56 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 3hyh s ILE 57 N -2.71 3.09 0.00 5.09 1.01 -1.26 -3.49 121.20 122.93 3hyh s ILE 57 Ca 0.18 0.37 0.00 0.00 0.00 0.00 0.00 60.65 61.20 3hyh s ILE 57 Cb -0.05 -3.24 0.00 0.00 0.01 0.00 0.00 42.46 39.18 3hyh s ILE 57 CO 0.76 -0.02 0.00 0.52 0.00 0.00 0.00 174.94 176.20 3hyh n VAL 58 N 5.09 0.00 -4.26 2.92 0.31 0.21 -4.97 118.33 117.62 3hyh n VAL 58 Ca 0.17 0.36 -0.29 0.00 -0.01 0.00 0.00 64.34 64.57 3hyh n VAL 58 Cb 0.41 -1.32 -0.03 0.00 -0.91 0.00 0.00 33.84 31.98 3hyh n VAL 58 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 3hyh s LYS 59 N -0.72 2.23 -0.06 5.55 1.02 -1.22 -4.95 119.74 121.59 3hyh s LYS 59 Ca 0.00 -2.19 -0.02 0.00 0.02 0.00 0.00 55.97 53.78 3hyh s LYS 59 Cb 0.00 -1.85 0.03 0.00 -0.52 0.00 0.00 37.83 35.48 3hyh s LYS 59 CO 0.00 -0.52 0.03 -0.08 -0.92 0.00 0.00 175.35 173.85 3hyh s THR 60 N -2.82 0.18 -0.47 2.17 -1.32 -1.26 -2.58 115.64 109.53 3hyh s THR 60 Ca 0.21 0.25 0.07 0.00 -1.21 0.00 0.00 61.69 61.01 3hyh s THR 60 Cb -0.01 -0.38 0.25 0.00 -1.51 0.00 0.00 72.50 70.86 3hyh s THR 60 CO 0.13 0.23 0.61 0.18 -2.21 0.00 0.00 174.62 173.55 3hyh n LEU 61 N 5.21 1.41 0.00 9.08 4.77 -0.83 -5.03 117.00 131.61 3hyh n LEU 61 Ca -0.05 -4.96 0.00 0.00 -0.03 0.00 0.00 56.01 50.97 3hyh n LEU 61 Cb 0.50 0.20 0.00 0.00 -2.33 0.00 0.00 43.42 41.79 3hyh n LEU 61 CO 0.09 2.08 0.00 0.61 -1.33 0.00 0.00 177.39 178.83 3hyh n GLY 62 N 1.18 -0.61 0.24 -0.72 0.00 -1.21 -4.26 105.19 99.80 3hyh n GLY 62 Ca 0.24 -1.42 -0.15 0.00 0.00 0.00 0.00 46.02 44.69 3hyh n GLY 62 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3hyh h GLU 63 N 0.00 -0.51 -6.02 1.61 4.39 -2.01 -3.43 114.58 108.62 3hyh h GLU 63 Ca 0.00 0.04 -0.65 0.00 0.34 0.00 0.00 59.36 59.08 3hyh h GLU 63 Cb 0.00 0.12 -0.31 0.00 -0.10 0.00 0.00 28.75 28.46 3hyh h GLU 63 CO 0.00 -0.27 -0.87 0.21 -1.16 0.00 0.00 179.01 176.92 3hyh s LYS 68 N -5.55 2.13 -0.08 2.33 2.20 -1.16 -5.31 119.74 114.29 3hyh s LYS 68 Ca -0.15 -0.82 0.02 0.00 -0.36 0.00 0.00 55.97 54.66 3hyh s LYS 68 Cb 0.03 -1.91 -0.02 0.00 -1.51 0.00 0.00 37.83 34.43 3hyh s LYS 68 CO 0.60 0.41 -0.14 0.08 -0.36 0.00 0.00 175.35 175.94 3hyh s VAL 69 N -0.30 3.01 0.12 4.02 1.01 -1.26 -1.50 120.40 125.51 3hyh s VAL 69 Ca 0.02 -0.71 0.06 0.00 0.00 0.00 0.00 61.98 61.34 3hyh s VAL 69 Cb -0.11 -2.21 -0.04 0.00 0.00 0.00 0.00 36.38 34.02 3hyh s VAL 69 CO 0.01 0.56 -0.14 -0.54 0.00 0.00 0.00 175.10 175.00 3hyh s LYS 70 N -0.28 1.02 -0.02 2.72 1.02 -0.81 -1.97 119.74 121.42 3hyh s LYS 70 Ca 0.02 -1.23 -0.12 0.00 0.02 0.00 0.00 55.97 54.66 3hyh s LYS 70 Cb -0.13 -0.91 -0.05 0.00 -0.52 0.00 0.00 37.83 36.22 3hyh s LYS 70 CO 0.03 0.18 0.34 -1.17 -0.92 0.00 0.00 175.35 173.80 3hyh s LEU 71 N -2.42 4.44 0.30 3.17 2.96 -1.06 -0.62 118.68 125.45 3hyh s LEU 71 Ca 0.08 0.82 -0.08 0.00 -0.22 0.00 0.00 54.13 54.74 3hyh s LEU 71 Cb -0.05 -2.50 0.00 0.00 0.50 0.00 0.00 46.19 44.15 3hyh s LEU 71 CO 0.03 0.33 0.49 0.00 -1.32 0.00 0.00 176.35 175.89 3hyh s ALA 72 N -1.10 0.23 -0.09 5.97 0.00 -0.22 0.65 121.76 127.20 3hyh s ALA 72 Ca 0.22 -1.19 -0.11 0.00 0.00 0.00 0.00 51.96 50.88 3hyh s ALA 72 Cb -0.15 1.08 0.03 0.00 0.00 0.00 0.00 23.12 24.08 3hyh s ALA 72 CO 0.12 -0.83 0.29 1.52 0.00 0.00 0.00 175.76 176.86 3hyh s TYR 73 N -3.41 -0.29 0.04 0.00 -0.85 -0.78 0.11 117.35 112.17 3hyh s TYR 73 Ca 0.26 0.67 -0.30 0.00 -0.52 0.00 0.00 57.07 57.18 3hyh s TYR 73 Cb -0.01 0.10 -0.08 0.00 0.38 0.00 0.00 41.96 42.36 3hyh s TYR 73 CO 0.14 -0.20 1.74 -1.58 -1.52 0.00 0.00 175.55 174.14 3hyh s HIS 74 N -0.13 2.02 0.57 -3.49 5.65 0.95 -3.50 115.29 117.36 3hyh s HIS 74 Ca -0.03 0.07 0.27 0.00 0.25 0.00 0.00 55.06 55.63 3hyh s HIS 74 Cb -0.03 -4.04 1.57 0.00 -1.18 0.00 0.00 32.58 28.90 3hyh s HIS 74 CO 0.01 -4.37 2.07 0.00 -0.65 0.00 0.00 174.74 171.80 3hyh h THR 75 N 5.17 0.55 0.00 0.89 1.03 -1.91 0.28 112.91 118.92 3hyh h THR 75 Ca -0.44 0.00 -0.30 0.00 -0.01 0.00 0.00 66.41 65.66 3hyh h THR 75 Cb 1.21 0.82 -0.05 0.00 -1.07 0.00 0.00 68.15 69.06 3hyh h THR 75 CO 0.94 0.00 -1.92 0.41 -0.01 0.00 0.00 175.52 174.94 3hyh n THR 76 N -3.95 1.52 0.28 0.00 -1.04 -1.26 -4.58 114.28 105.25 3hyh n THR 76 Ca 0.03 -0.19 0.12 0.00 -2.04 0.00 0.00 64.05 61.98 3hyh n THR 76 Cb 0.38 -2.04 0.18 0.00 -1.82 0.00 0.00 70.33 67.03 3hyh n THR 76 CO 0.00 0.00 0.00 0.74 -0.64 0.00 0.00 175.07 175.17 3hyh h THR 77 N -1.00 0.00 0.00 12.58 2.02 -1.96 -3.47 112.91 121.08 3hyh h THR 77 Ca -0.46 -0.89 0.00 0.00 0.77 0.00 0.00 66.41 65.83 3hyh h THR 77 Cb 1.38 1.80 0.00 0.00 -1.74 0.00 0.00 68.15 69.58 3hyh h THR 77 CO -0.28 0.00 0.00 0.61 0.37 0.00 0.00 175.52 176.22 3hyh n GLY 78 N 1.16 0.38 3.66 2.16 0.00 0.98 -4.96 105.19 108.57 3hyh n GLY 78 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 3hyh n GLY 78 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3hyh s GLN 79 N -0.59 4.08 0.19 1.61 2.00 -1.24 -4.52 119.66 121.18 3hyh s GLN 79 Ca 0.00 2.51 -0.30 0.00 -2.00 0.00 0.00 55.36 55.58 3hyh s GLN 79 Cb 0.00 -4.15 -0.08 0.00 0.80 0.00 0.00 33.01 29.58 3hyh s GLN 79 CO 0.00 -1.02 1.11 0.15 -0.50 0.00 0.00 175.29 175.03 3hyh s LYS 80 N 4.53 4.59 0.02 1.67 1.02 -1.26 -0.04 119.74 130.27 3hyh s LYS 80 Ca 0.87 1.74 0.01 0.00 0.02 0.00 0.00 55.97 58.61 3hyh s LYS 80 Cb -0.41 -3.26 -0.02 0.00 -0.52 0.00 0.00 37.83 33.62 3hyh s LYS 80 CO 0.40 0.07 -0.04 0.08 -0.92 0.00 0.00 175.35 174.93 3hyh s VAL 81 N -0.31 0.27 -0.13 3.17 1.01 0.12 -2.08 120.40 122.46 3hyh s VAL 81 Ca 0.49 -0.77 -0.05 0.00 0.00 0.00 0.00 61.98 61.65 3hyh s VAL 81 Cb -0.30 -0.35 -0.04 0.00 0.00 0.00 0.00 36.38 35.69 3hyh s VAL 81 CO 0.36 -0.33 0.07 0.00 0.00 0.00 0.00 175.10 175.20 3hyh s ALA 82 N -1.09 3.54 -0.30 5.51 0.00 0.16 -1.05 121.76 128.53 3hyh s ALA 82 Ca -0.10 -0.73 -0.08 0.00 0.00 0.00 0.00 51.96 51.06 3hyh s ALA 82 Cb -0.08 -1.80 0.01 0.00 0.00 0.00 0.00 23.12 21.25 3hyh s ALA 82 CO -0.00 0.47 0.11 -0.51 0.00 0.00 0.00 175.76 175.82 3hyh s LEU 83 N -0.53 3.97 -0.42 0.00 1.43 0.20 -0.28 118.68 123.05 3hyh s LEU 83 Ca 0.11 -0.67 -0.13 0.00 -1.03 0.00 0.00 54.13 52.41 3hyh s LEU 83 Cb -0.12 -1.92 0.04 0.00 0.03 0.00 0.00 46.19 44.22 3hyh s LEU 83 CO 0.02 -0.20 0.29 -0.54 0.23 0.00 0.00 176.35 176.15 3hyh s LYS 84 N 1.53 2.88 -0.35 1.70 1.02 0.56 -1.93 119.74 125.16 3hyh s LYS 84 Ca 0.03 -1.17 -0.16 0.00 0.02 0.00 0.00 55.97 54.69 3hyh s LYS 84 Cb -0.17 -3.92 -0.01 0.00 -0.52 0.00 0.00 37.83 33.21 3hyh s LYS 84 CO 0.04 -0.83 0.39 0.42 -0.92 0.00 0.00 175.35 174.44 3hyh s ILE 85 N 1.60 5.14 -0.10 2.17 1.01 -0.56 -0.73 121.20 129.73 3hyh s ILE 85 Ca 0.04 0.05 0.01 0.00 0.00 0.00 0.00 60.65 60.74 3hyh s ILE 85 Cb -0.21 -3.86 -0.02 0.00 0.01 0.00 0.00 42.46 38.38 3hyh s ILE 85 CO 0.07 -0.14 -0.11 -0.63 0.00 0.00 0.00 174.94 174.13 3hyh s ILE 86 N 2.07 3.27 0.00 2.92 -1.09 0.51 -3.01 121.20 125.88 3hyh s ILE 86 Ca 0.13 -0.61 0.00 0.00 -2.23 0.00 0.00 60.65 57.93 3hyh s ILE 86 Cb -0.16 -2.35 0.00 0.00 -1.58 0.00 0.00 42.46 38.37 3hyh s ILE 86 CO 0.12 0.55 0.00 -0.46 -1.23 0.00 0.00 174.94 173.92 3hyh n ASN 87 N 2.95 0.00 0.00 3.58 6.94 -1.26 -0.33 115.26 127.13 3hyh n ASN 87 Ca -0.18 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.38 3hyh n ASN 87 Cb 0.53 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.95 3hyh n ASN 87 CO 0.00 0.00 0.00 2.29 -1.03 0.00 0.00 177.26 178.52 3hyh n LYS 88 N 0.00 0.00 -2.68 -3.83 2.85 -1.26 -4.45 118.16 108.79 3hyh n LYS 88 Ca 0.00 0.04 -0.42 0.00 -1.05 0.00 0.00 58.31 56.88 3hyh n LYS 88 Cb 0.00 -0.07 -0.03 0.00 -0.65 0.00 0.00 35.03 34.28 3hyh n LYS 88 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 177.40 177.56 3hyh s LYS 89 N -2.22 4.58 -0.28 -1.58 2.20 -1.26 -5.19 119.74 115.98 3hyh s LYS 89 Ca 0.00 1.46 -0.05 0.00 -0.36 0.00 0.00 55.97 57.02 3hyh s LYS 89 Cb 0.00 -3.43 0.15 0.00 -1.51 0.00 0.00 37.83 33.04 3hyh s LYS 89 CO 0.00 -0.01 0.58 0.54 -0.36 0.00 0.00 175.35 176.09 3hyh s VAL 90 N 0.78 -0.92 0.34 4.02 0.11 -1.26 -4.95 120.40 118.52 3hyh s VAL 90 Ca 0.52 0.01 0.05 0.00 -2.93 0.00 0.00 61.98 59.62 3hyh s VAL 90 Cb -0.22 -0.95 -0.07 0.00 -1.53 0.00 0.00 36.38 33.61 3hyh s VAL 90 CO 0.29 -0.01 0.04 -0.04 -3.33 0.00 0.00 175.10 172.06 3hyh s MET 96 N 2.82 1.71 0.17 1.54 1.00 -1.26 -5.21 119.30 120.07 3hyh s MET 96 Ca 0.08 -1.95 -0.15 0.00 0.00 0.00 0.00 55.69 53.67 3hyh s MET 96 Cb -0.14 -1.03 0.06 0.00 0.00 0.00 0.00 34.83 33.72 3hyh s MET 96 CO -0.19 -0.15 1.82 1.96 0.00 0.00 0.00 175.02 178.46 3hyh h GLN 97 N 2.05 0.60 -0.63 2.03 4.20 -2.00 -2.87 115.11 118.50 3hyh h GLN 97 Ca -0.41 -0.04 0.02 0.00 0.06 0.00 0.00 58.65 58.28 3hyh h GLN 97 Cb 1.24 -0.14 -0.03 0.00 0.30 0.00 0.00 27.48 28.85 3hyh h GLN 97 CO 0.72 0.40 0.42 0.78 -0.67 0.00 0.00 178.83 180.47 3hyh h GLY 98 N 0.62 0.86 1.36 3.46 0.00 -2.04 -0.13 103.07 107.21 3hyh h GLY 98 Ca 0.18 -0.31 -0.32 0.00 0.00 0.00 0.00 47.33 46.88 3hyh h GLY 98 CO -0.06 0.29 -1.42 3.21 0.00 0.00 0.00 176.54 178.56 3hyh h ARG 99 N 0.79 0.48 -0.29 4.80 3.08 -1.96 -1.18 114.38 120.10 3hyh h ARG 99 Ca 0.24 -0.81 -0.04 0.00 0.07 0.00 0.00 59.98 59.44 3hyh h ARG 99 Cb -0.00 0.30 -0.01 0.00 0.08 0.00 0.00 29.97 30.34 3hyh h ARG 99 CO -0.06 1.39 0.02 0.82 -1.07 0.00 0.00 179.97 181.06 3hyh h ILE 100 N 0.13 1.25 -0.86 2.04 1.08 -1.43 -0.49 117.51 119.23 3hyh h ILE 100 Ca -0.22 -0.89 0.05 0.00 -0.39 0.00 0.00 64.86 63.40 3hyh h ILE 100 Cb 2.12 1.26 -0.05 0.00 -3.07 0.00 0.00 36.82 37.07 3hyh h ILE 100 CO 0.26 0.29 0.57 -0.33 -0.69 0.00 0.00 178.15 178.24 3hyh h GLU 101 N 0.31 1.00 -0.29 2.37 3.07 -1.08 -1.22 114.58 118.74 3hyh h GLU 101 Ca 0.09 -0.06 -0.02 0.00 -0.50 0.00 0.00 59.36 58.86 3hyh h GLU 101 Cb 0.40 -0.22 -0.01 0.00 -0.84 0.00 0.00 28.75 28.08 3hyh h GLU 101 CO 0.01 0.66 0.09 -0.09 -1.40 0.00 0.00 179.01 178.28 3hyh h ARG 102 N 1.03 0.45 0.12 2.33 2.43 -1.00 -0.97 114.38 118.76 3hyh h ARG 102 Ca 0.36 -0.10 0.02 0.00 -0.81 0.00 0.00 59.98 59.44 3hyh h ARG 102 Cb 0.11 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.57 3hyh h ARG 102 CO -0.12 0.51 -0.24 0.93 -1.51 0.00 0.00 179.97 179.54 3hyh h GLU 103 N 0.30 -0.43 0.03 0.20 4.39 -0.65 0.48 114.58 118.90 3hyh h GLU 103 Ca 0.09 0.03 0.03 0.00 0.34 0.00 0.00 59.36 59.85 3hyh h GLU 103 Cb 0.25 0.10 -0.05 0.00 -0.10 0.00 0.00 28.75 28.95 3hyh h GLU 103 CO -0.00 -0.29 -0.29 0.82 -1.16 0.00 0.00 179.01 178.09 3hyh h ILE 104 N -0.44 0.36 -0.24 3.13 2.04 -1.20 -0.97 117.51 120.18 3hyh h ILE 104 Ca 0.03 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.92 3hyh h ILE 104 Cb 0.47 0.36 -0.03 0.00 -0.74 0.00 0.00 36.82 36.87 3hyh h ILE 104 CO -0.14 0.00 0.05 0.77 0.00 0.00 0.00 178.15 178.84 3hyh h SER 105 N -0.45 0.02 -0.51 1.72 4.64 -0.99 0.06 113.55 118.04 3hyh h SER 105 Ca 0.05 0.04 0.03 0.00 -0.47 0.00 0.00 61.79 61.44 3hyh h SER 105 Cb 0.53 0.05 -0.04 0.00 -0.31 0.00 0.00 62.40 62.63 3hyh h SER 105 CO -0.23 0.05 0.29 1.88 -0.87 0.00 0.00 176.83 177.94 3hyh h TYR 106 N 0.15 0.53 0.23 4.77 -1.99 -0.72 -1.46 116.97 118.48 3hyh h TYR 106 Ca 0.11 0.02 -0.01 0.00 2.00 0.00 0.00 58.73 60.85 3hyh h TYR 106 Cb 0.11 -0.17 0.00 0.00 2.00 0.00 0.00 36.73 38.67 3hyh h TYR 106 CO -0.15 0.29 -0.11 -0.07 -0.00 0.00 0.00 178.16 178.12 3hyh h LEU 107 N 0.57 -0.26 -1.32 3.88 3.38 -0.88 -1.84 115.31 118.84 3hyh h LEU 107 Ca 0.21 -0.19 0.15 0.00 0.09 0.00 0.00 57.88 58.14 3hyh h LEU 107 Cb 0.06 0.07 -0.07 0.00 0.09 0.00 0.00 40.66 40.81 3hyh h LEU 107 CO -0.11 0.06 0.57 -0.09 0.09 0.00 0.00 178.44 178.96 3hyh h ARG 108 N -0.60 0.63 -0.02 1.13 2.43 -0.93 -1.09 114.38 115.93 3hyh h ARG 108 Ca -0.03 -0.04 -0.19 0.00 -0.81 0.00 0.00 59.98 58.91 3hyh h ARG 108 Cb 0.43 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.83 3hyh h ARG 108 CO 0.05 0.42 -0.82 1.25 -1.51 0.00 0.00 179.97 179.36 3hyh h LEU 109 N 0.65 0.29 -8.21 3.80 5.85 -1.20 -3.43 115.31 113.07 3hyh h LEU 109 Ca 0.45 -0.22 -0.74 0.00 0.84 0.00 0.00 57.88 58.21 3hyh h LEU 109 Cb 0.77 -0.09 -0.22 0.00 0.37 0.00 0.00 40.66 41.49 3hyh h LEU 109 CO -0.20 0.99 -0.18 -0.76 -0.34 0.00 0.00 178.44 177.95 3hyh s LEU 110 N -7.58 5.73 -0.37 2.25 1.43 -0.41 -5.01 118.68 114.72 3hyh s LEU 110 Ca -0.03 -1.47 -0.14 0.00 -1.03 0.00 0.00 54.13 51.46 3hyh s LEU 110 Cb 0.10 -2.24 -0.00 0.00 0.03 0.00 0.00 46.19 44.08 3hyh s LEU 110 CO 0.83 -0.83 0.26 -0.13 0.23 0.00 0.00 176.35 176.71 3hyh s ARG 111 N 1.90 3.30 -0.16 1.70 1.81 -1.26 -4.86 118.95 121.37 3hyh s ARG 111 Ca 0.06 -0.78 -0.20 0.00 -1.72 0.00 0.00 55.73 53.09 3hyh s ARG 111 Cb -0.26 -3.87 0.05 0.00 -0.45 0.00 0.00 34.95 30.42 3hyh s ARG 111 CO 0.06 -0.56 0.52 -1.58 -0.68 0.00 0.00 175.30 173.07 3hyh s HIS 112 N 1.71 -0.54 0.16 -0.53 2.46 -1.26 -5.05 115.29 112.23 3hyh s HIS 112 Ca 0.06 1.24 0.33 0.00 0.47 0.00 0.00 55.06 57.16 3hyh s HIS 112 Cb -0.18 0.21 1.70 0.00 -0.13 0.00 0.00 32.58 34.18 3hyh s HIS 112 CO 0.10 -0.34 1.99 -1.35 -2.47 0.00 0.00 174.74 172.68 3hyh h PRO 113 N 4.82 0.00 -0.06 2.88 0.11 -1.97 -2.63 132.00 135.14 3hyh h PRO 113 Ca -0.28 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.80 3hyh h PRO 113 Cb 1.17 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.26 3hyh h PRO 113 CO 0.23 0.00 -0.37 0.72 -0.21 0.00 0.00 178.00 178.37 3hyh n HIS 114 N -2.68 0.20 -4.25 0.65 8.25 -1.26 -4.87 115.22 111.26 3hyh n HIS 114 Ca -0.02 -1.45 -0.25 0.00 -0.26 0.00 0.00 57.72 55.74 3hyh n HIS 114 Cb 0.10 -0.28 -0.17 0.00 1.12 0.00 0.00 29.99 30.76 3hyh n HIS 114 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3hyh s ILE 115 N -3.20 0.99 0.19 1.59 1.01 -0.99 -0.65 121.20 120.14 3hyh s ILE 115 Ca 0.39 -0.34 -0.32 0.00 0.00 0.00 0.00 60.65 60.37 3hyh s ILE 115 Cb 0.37 -0.96 -0.15 0.00 0.01 0.00 0.00 42.46 41.72 3hyh s ILE 115 CO -0.05 0.34 1.16 0.00 0.00 0.00 0.00 174.94 176.39 3hyh n ILE 116 N 4.30 0.99 -3.16 2.92 0.13 0.11 -4.60 119.36 120.05 3hyh n ILE 116 Ca -0.19 -0.25 -0.37 0.00 -1.10 0.00 0.00 62.75 60.85 3hyh n ILE 116 Cb 0.51 -0.88 -0.06 0.00 -0.84 0.00 0.00 39.64 38.36 3hyh n ILE 116 CO 0.00 0.00 0.00 -0.54 2.80 0.00 0.00 176.55 178.81 3hyh s LYS 117 N -0.48 4.22 -0.37 9.51 1.02 -1.26 -4.93 119.74 127.46 3hyh s LYS 117 Ca 0.72 0.81 -0.10 0.00 0.02 0.00 0.00 55.97 57.42 3hyh s LYS 117 Cb -0.83 -2.99 0.03 0.00 -0.52 0.00 0.00 37.83 33.53 3hyh s LYS 117 CO 0.53 0.47 0.18 -1.17 -0.92 0.00 0.00 175.35 174.44 3hyh s LEU 118 N -1.75 4.64 0.08 3.17 2.96 -1.26 -0.26 118.68 126.26 3hyh s LEU 118 Ca 0.39 -1.08 -0.06 0.00 -0.22 0.00 0.00 54.13 53.16 3hyh s LEU 118 Cb -0.17 -1.98 -0.26 0.00 0.50 0.00 0.00 46.19 44.28 3hyh s LEU 118 CO 0.21 -0.38 1.15 1.88 -1.32 0.00 0.00 176.35 177.89 3hyh h TYR 119 N 8.37 0.61 -2.68 5.38 0.05 -0.44 -3.46 116.97 124.80 3hyh h TYR 119 Ca -0.25 -0.42 -0.01 0.00 0.05 0.00 0.00 58.73 58.10 3hyh h TYR 119 Cb 1.10 -0.03 -0.14 0.00 1.01 0.00 0.00 36.73 38.66 3hyh h TYR 119 CO 0.58 1.31 0.25 0.34 -1.05 0.00 0.00 178.16 179.58 3hyh s ASP 120 N -7.22 -0.56 -0.23 3.88 3.68 -1.13 -5.01 116.67 110.08 3hyh s ASP 120 Ca -0.05 0.16 -0.01 0.00 2.13 0.00 0.00 52.55 54.77 3hyh s ASP 120 Cb 0.07 0.56 0.07 0.00 -1.45 0.00 0.00 42.92 42.16 3hyh s ASP 120 CO 0.89 -0.84 0.02 -0.69 0.13 0.00 0.00 175.17 174.68 3hyh s VAL 121 N -3.09 0.92 -0.26 1.11 1.01 -1.26 -0.52 120.40 118.31 3hyh s VAL 121 Ca -0.01 -0.93 -0.12 0.00 0.00 0.00 0.00 61.98 60.92 3hyh s VAL 121 Cb -0.01 -1.39 -0.05 0.00 0.00 0.00 0.00 36.38 34.93 3hyh s VAL 121 CO -0.07 -0.26 0.25 -0.63 0.00 0.00 0.00 175.10 174.39 3hyh s ILE 122 N 1.66 5.27 -0.03 2.22 1.01 -0.17 -4.93 121.20 126.23 3hyh s ILE 122 Ca -0.01 0.33 0.06 0.00 0.00 0.00 0.00 60.65 61.03 3hyh s ILE 122 Cb -0.18 -3.59 -0.01 0.00 0.01 0.00 0.00 42.46 38.69 3hyh s ILE 122 CO -0.10 0.24 -0.20 -0.54 0.00 0.00 0.00 174.94 174.35 3hyh s LYS 123 N 1.66 1.74 0.09 2.79 1.02 -1.26 0.48 119.74 126.27 3hyh s LYS 123 Ca 0.10 -0.70 0.01 0.00 0.02 0.00 0.00 55.97 55.40 3hyh s LYS 123 Cb -0.15 -1.61 -0.00 0.00 -0.52 0.00 0.00 37.83 35.55 3hyh s LYS 123 CO 0.09 0.37 0.03 -1.13 -0.92 0.00 0.00 175.35 173.80 3hyh n SER 124 N 2.78 1.06 0.17 2.83 3.41 -0.00 -5.01 113.62 118.85 3hyh n SER 124 Ca -0.16 -1.50 0.04 0.00 -0.26 0.00 0.00 58.87 57.00 3hyh n SER 124 Cb 0.53 0.23 0.46 0.00 -0.26 0.00 0.00 64.21 65.17 3hyh n SER 124 CO 0.00 0.00 0.00 0.07 -0.16 0.00 0.00 175.04 174.95 3hyh h LYS 125 N 0.00 0.13 0.07 4.33 2.10 -2.03 -3.34 116.57 117.83 3hyh h LYS 125 Ca -0.07 -0.02 -0.37 0.00 -2.00 0.00 0.00 60.65 58.18 3hyh h LYS 125 Cb 0.28 -0.02 -0.04 0.00 -0.90 0.00 0.00 32.23 31.55 3hyh h LYS 125 CO 0.12 0.26 -2.14 -0.25 -2.00 0.00 0.00 179.45 175.43 3hyh n ASP 126 N -4.33 2.05 -4.07 7.07 8.00 -1.26 -5.04 116.55 118.97 3hyh n ASP 126 Ca -0.01 0.11 -0.08 0.00 0.71 0.00 0.00 54.79 55.52 3hyh n ASP 126 Cb 0.23 -0.72 -0.10 0.00 -0.02 0.00 0.00 41.12 40.51 3hyh n ASP 126 CO 0.00 0.00 0.00 -1.83 -0.39 0.00 0.00 177.20 174.98 3hyh s GLU 127 N -2.53 0.72 -0.16 -1.24 -1.05 -1.26 -4.55 118.70 108.64 3hyh s GLU 127 Ca -0.28 -1.24 0.01 0.00 -0.15 0.00 0.00 54.97 53.32 3hyh s GLU 127 Cb 0.08 0.24 0.01 0.00 -0.44 0.00 0.00 34.13 34.01 3hyh s GLU 127 CO 0.69 -0.17 -0.19 0.42 0.95 0.00 0.00 175.26 176.96 3hyh s ILE 128 N -3.94 2.31 -0.30 1.83 1.01 0.55 -0.82 121.20 121.83 3hyh s ILE 128 Ca 0.11 -0.88 -0.03 0.00 0.00 0.00 0.00 60.65 59.85 3hyh s ILE 128 Cb 0.07 -1.96 0.05 0.00 0.01 0.00 0.00 42.46 40.63 3hyh s ILE 128 CO -0.07 0.53 0.01 -0.63 0.00 0.00 0.00 174.94 174.78 3hyh s ILE 129 N 0.97 3.13 -0.05 2.92 1.01 0.18 -0.36 121.20 128.99 3hyh s ILE 129 Ca -0.03 -1.31 -0.24 0.00 0.00 0.00 0.00 60.65 59.07 3hyh s ILE 129 Cb -0.15 -2.78 -0.04 0.00 0.01 0.00 0.00 42.46 39.50 3hyh s ILE 129 CO -0.04 -0.10 0.74 -0.04 0.00 0.00 0.00 174.94 175.50 3hyh s MET 130 N 1.29 4.45 -0.50 2.79 -1.94 0.09 -1.00 119.30 124.47 3hyh s MET 130 Ca -0.04 0.95 -0.09 0.00 -1.71 0.00 0.00 55.69 54.79 3hyh s MET 130 Cb -0.20 -3.45 0.13 0.00 2.01 0.00 0.00 34.83 33.33 3hyh s MET 130 CO -0.00 0.06 0.38 0.08 -0.01 0.00 0.00 175.02 175.52 3hyh s VAL 131 N 0.80 4.32 -0.08 -6.03 1.01 0.32 -0.32 120.40 120.41 3hyh s VAL 131 Ca 0.39 -1.87 0.02 0.00 0.00 0.00 0.00 61.98 60.53 3hyh s VAL 131 Cb -0.18 -3.83 -0.02 0.00 0.00 0.00 0.00 36.38 32.35 3hyh s VAL 131 CO 0.19 -0.80 -0.14 -0.63 0.00 0.00 0.00 175.10 173.72 3hyh s ILE 132 N 1.24 3.01 0.08 2.22 1.01 0.61 0.38 121.20 129.75 3hyh s ILE 132 Ca 0.07 -0.71 -0.37 0.00 0.00 0.00 0.00 60.65 59.64 3hyh s ILE 132 Cb -0.25 -2.21 -0.18 0.00 0.01 0.00 0.00 42.46 39.83 3hyh s ILE 132 CO -0.01 0.56 1.15 1.21 0.00 0.00 0.00 174.94 177.85 3hyh n GLU 133 N 2.84 0.65 -3.14 2.79 2.13 0.65 0.41 120.64 126.96 3hyh n GLU 133 Ca -0.18 0.23 -0.40 0.00 0.66 0.00 0.00 57.16 57.48 3hyh n GLU 133 Cb 0.52 -1.75 -0.06 0.00 0.27 0.00 0.00 31.44 30.42 3hyh n GLU 133 CO 0.00 0.00 0.00 -0.47 -0.41 0.00 0.00 177.13 176.25 3hyh s TYR 134 N 0.08 3.37 -0.21 4.31 5.04 -0.88 -4.57 117.35 124.49 3hyh s TYR 134 Ca 0.83 0.89 -0.02 0.00 -2.44 0.00 0.00 57.07 56.34 3hyh s TYR 134 Cb -1.05 -2.77 0.06 0.00 0.35 0.00 0.00 41.96 38.55 3hyh s TYR 134 CO 0.52 -0.16 0.01 0.00 -1.34 0.00 0.00 175.55 174.57 3hyh s ALA 135 N 1.87 1.32 -2.43 3.97 0.00 -1.26 -4.89 121.76 120.34 3hyh s ALA 135 Ca 0.28 -0.92 0.27 0.00 0.00 0.00 0.00 51.96 51.59 3hyh s ALA 135 Cb -0.16 -1.27 1.03 0.00 0.00 0.00 0.00 23.12 22.73 3hyh s ALA 135 CO 0.10 -1.18 1.73 0.41 0.00 0.00 0.00 175.76 176.82 3hyh n GLY 136 N 4.92 -0.00 3.29 0.00 0.00 -1.24 -4.74 105.19 107.42 3hyh n GLY 136 Ca -0.10 -0.42 -0.23 0.00 0.00 0.00 0.00 46.02 45.27 3hyh n GLY 136 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3hyh s ASN 137 N -1.91 2.50 -0.00 1.61 0.01 -1.14 -5.02 114.94 110.99 3hyh s ASN 137 Ca 0.37 -0.73 -0.02 0.00 -0.71 0.00 0.00 52.86 51.77 3hyh s ASN 137 Cb 0.20 -0.14 -0.04 0.00 0.41 0.00 0.00 41.25 41.69 3hyh s ASN 137 CO 0.32 0.02 0.17 -1.61 -1.51 0.00 0.00 177.10 174.49 3hyh s GLU 138 N -2.15 3.39 0.18 -0.60 2.02 -1.26 0.75 118.70 121.02 3hyh s GLU 138 Ca 0.08 -0.36 -0.13 0.00 0.02 0.00 0.00 54.97 54.59 3hyh s GLU 138 Cb -0.09 -3.06 0.15 0.00 0.10 0.00 0.00 34.13 31.23 3hyh s GLU 138 CO 0.05 0.66 1.77 1.25 0.02 0.00 0.00 175.26 179.01 3hyh h LEU 139 N 3.77 0.28 -1.09 1.80 5.85 -0.87 -2.51 115.31 122.54 3hyh h LEU 139 Ca -0.49 0.04 -0.05 0.00 0.84 0.00 0.00 57.88 58.23 3hyh h LEU 139 Cb 1.18 -0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.20 3hyh h LEU 139 CO 0.69 0.20 -0.22 -0.26 -0.34 0.00 0.00 178.44 178.51 3hyh h PHE 140 N 0.43 0.00 -0.46 1.25 -1.00 -1.82 -0.83 116.94 114.51 3hyh h PHE 140 Ca 0.23 0.00 -0.11 0.00 2.81 0.00 0.00 57.97 60.90 3hyh h PHE 140 Cb 0.18 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.73 3hyh h PHE 140 CO -0.13 0.22 -0.13 -0.44 -1.61 0.00 0.00 178.31 176.22 3hyh h ASP 141 N 0.00 0.91 -0.18 2.17 3.45 -1.89 -2.23 116.42 118.65 3hyh h ASP 141 Ca -0.00 -0.37 -0.08 0.00 0.43 0.00 0.00 57.03 57.01 3hyh h ASP 141 Cb 0.75 -0.25 -0.02 0.00 -0.56 0.00 0.00 39.33 39.26 3hyh h ASP 141 CO 0.03 1.07 -0.15 0.22 -1.57 0.00 0.00 179.24 178.84 3hyh h TYR 142 N 0.74 0.63 -0.11 4.55 3.20 -0.96 -1.60 116.97 123.42 3hyh h TYR 142 Ca 0.11 -0.11 -0.02 0.00 3.14 0.00 0.00 58.73 61.85 3hyh h TYR 142 Cb 0.68 -0.16 -0.00 0.00 1.54 0.00 0.00 36.73 38.78 3hyh h TYR 142 CO 0.05 0.70 -0.02 0.82 -1.64 0.00 0.00 178.16 178.07 3hyh h ILE 143 N 0.53 1.28 -0.31 1.81 2.04 -1.13 -3.25 117.51 118.48 3hyh h ILE 143 Ca 0.09 -0.90 -0.11 0.00 1.00 0.00 0.00 64.86 64.94 3hyh h ILE 143 Cb 0.56 1.65 -0.01 0.00 -0.74 0.00 0.00 36.82 38.28 3hyh h ILE 143 CO 0.04 0.26 -0.25 0.58 0.00 0.00 0.00 178.15 178.77 3hyh h VAL 144 N -0.09 1.27 -0.18 1.67 2.07 -1.32 -3.03 116.25 116.65 3hyh h VAL 144 Ca 0.03 -1.32 0.00 0.00 0.82 0.00 0.00 66.70 66.23 3hyh h VAL 144 Cb 0.41 1.31 0.00 0.00 -1.52 0.00 0.00 31.29 31.49 3hyh h VAL 144 CO 0.01 0.43 0.00 0.00 0.02 0.00 0.00 177.57 178.03 3hyh n GLN 145 N -4.11 1.47 -4.24 1.57 6.02 -0.61 -4.84 117.38 112.64 3hyh n GLN 145 Ca -0.00 -0.67 -0.14 0.00 -0.01 0.00 0.00 57.00 56.18 3hyh n GLN 145 Cb 0.43 -1.20 -0.10 0.00 1.02 0.00 0.00 30.24 30.39 3hyh n GLN 145 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 3hyh s ARG 146 N -1.72 1.25 0.95 -1.09 0.52 -1.14 -5.05 118.95 112.66 3hyh s ARG 146 Ca 0.12 -1.65 -0.12 0.00 -0.52 0.00 0.00 55.73 53.56 3hyh s ARG 146 Cb 0.07 0.00 0.16 0.00 0.52 0.00 0.00 34.95 35.70 3hyh s ARG 146 CO 0.08 -0.31 1.12 0.16 0.02 0.00 0.00 175.30 176.36 3hyh s ASP 147 N -3.21 3.14 -0.14 0.23 -4.77 -1.26 -4.92 116.67 105.74 3hyh s ASP 147 Ca 0.36 1.08 -0.36 0.00 -3.30 0.00 0.00 52.55 50.33 3hyh s ASP 147 Cb 0.07 -1.71 -0.13 0.00 -1.09 0.00 0.00 42.92 40.06 3hyh s ASP 147 CO 0.11 -2.79 1.82 1.17 0.70 0.00 0.00 175.17 176.17 3hyh n LYS 148 N -3.94 1.83 -1.59 2.11 4.81 -1.26 -4.93 118.16 115.19 3hyh n LYS 148 Ca 0.06 0.67 -0.31 0.00 -0.87 0.00 0.00 58.31 57.86 3hyh n LYS 148 Cb 0.58 -2.46 0.05 0.00 0.02 0.00 0.00 35.03 33.22 3hyh n LYS 148 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3hyh s MET 149 N 3.75 2.90 0.71 1.64 0.23 -1.26 -5.03 119.30 122.23 3hyh s MET 149 Ca 0.94 1.02 -0.12 0.00 -1.03 0.00 0.00 55.69 56.50 3hyh s MET 149 Cb -0.82 -1.98 0.02 0.00 -1.53 0.00 0.00 34.83 30.52 3hyh s MET 149 CO 0.56 -1.13 1.08 -1.54 -2.03 0.00 0.00 175.02 171.96 3hyh s SER 150 N -3.60 5.00 0.49 -1.18 1.04 -1.26 -4.86 113.70 109.32 3hyh s SER 150 Ca 0.59 1.82 0.20 0.00 0.48 0.00 0.00 55.95 59.04 3hyh s SER 150 Cb -0.15 -2.52 1.23 0.00 0.10 0.00 0.00 66.02 64.68 3hyh s SER 150 CO 0.53 -1.70 1.98 -0.33 0.98 0.00 0.00 173.24 174.70 3hyh h GLU 151 N -0.57 0.18 -0.20 4.02 5.08 -1.95 -1.92 114.58 119.22 3hyh h GLU 151 Ca -0.45 -0.01 -0.09 0.00 -1.00 0.00 0.00 59.36 57.81 3hyh h GLU 151 Cb 1.23 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 30.44 3hyh h GLU 151 CO 0.54 0.12 -0.23 1.96 -1.00 0.00 0.00 179.01 180.39 3hyh h GLN 152 N 0.18 0.51 -0.00 2.33 1.08 -1.98 -0.84 115.11 116.38 3hyh h GLN 152 Ca 0.27 -0.28 0.00 0.00 -1.45 0.00 0.00 58.65 57.19 3hyh h GLN 152 Cb 0.83 0.02 -0.00 0.00 -0.05 0.00 0.00 27.48 28.28 3hyh h GLN 152 CO -0.04 0.87 0.00 0.93 -0.95 0.00 0.00 178.83 179.64 3hyh h GLU 153 N 0.18 0.01 -0.79 1.46 5.08 -1.81 -0.22 114.58 118.48 3hyh h GLU 153 Ca 0.03 -0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.36 3hyh h GLU 153 Cb 0.79 -0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.00 3hyh h GLU 153 CO 0.06 0.02 0.41 0.00 -1.00 0.00 0.00 179.01 178.49 3hyh h ALA 154 N 0.99 1.02 -0.50 3.43 0.00 -1.41 -2.52 119.26 120.27 3hyh h ALA 154 Ca 0.00 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.72 3hyh h ALA 154 Cb 0.01 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 3hyh h ALA 154 CO -0.00 0.56 0.10 -0.09 0.00 0.00 0.00 179.25 179.82 3hyh h ARG 155 N 1.11 0.81 -0.23 0.00 2.43 -0.97 0.10 114.38 117.63 3hyh h ARG 155 Ca 0.28 -0.21 0.06 0.00 -0.81 0.00 0.00 59.98 59.30 3hyh h ARG 155 Cb 0.08 -0.10 -0.06 0.00 -0.42 0.00 0.00 29.97 29.47 3hyh h ARG 155 CO -0.04 0.79 -0.16 -0.09 -1.51 0.00 0.00 179.97 178.96 3hyh h ARG 156 N 0.69 -0.15 -0.30 0.20 2.43 -0.76 0.86 114.38 117.35 3hyh h ARG 156 Ca 0.15 0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.34 3hyh h ARG 156 Cb 0.36 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.93 3hyh h ARG 156 CO 0.01 -0.10 0.20 0.74 -1.51 0.00 0.00 179.97 179.30 3hyh h PHE 157 N -0.15 0.37 -0.62 2.20 0.04 -1.31 -2.73 116.94 114.73 3hyh h PHE 157 Ca 0.13 0.01 0.03 0.00 2.80 0.00 0.00 57.97 60.94 3hyh h PHE 157 Cb 0.35 -0.12 -0.04 0.00 2.20 0.00 0.00 35.95 38.34 3hyh h PHE 157 CO -0.33 0.23 0.38 0.35 -0.60 0.00 0.00 178.31 178.35 3hyh h PHE 158 N 0.40 0.71 -0.45 -0.55 3.57 -0.55 -0.75 116.94 119.32 3hyh h PHE 158 Ca 0.11 0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.68 3hyh h PHE 158 Cb -0.04 -0.23 -0.04 0.00 2.79 0.00 0.00 35.95 38.43 3hyh h PHE 158 CO -0.06 0.40 0.19 1.96 -2.23 0.00 0.00 178.31 178.58 3hyh h GLN 159 N 0.75 0.38 -0.52 1.11 4.20 -0.76 -0.07 115.11 120.20 3hyh h GLN 159 Ca 0.25 -0.02 0.03 0.00 0.06 0.00 0.00 58.65 58.97 3hyh h GLN 159 Cb 0.03 -0.09 -0.04 0.00 0.30 0.00 0.00 27.48 27.69 3hyh h GLN 159 CO -0.11 0.25 0.29 1.96 -0.67 0.00 0.00 178.83 180.55 3hyh h GLN 160 N 0.39 0.55 -0.01 1.46 4.20 -1.08 -1.41 115.11 119.20 3hyh h GLN 160 Ca 0.20 -0.03 -0.00 0.00 0.06 0.00 0.00 58.65 58.88 3hyh h GLN 160 Cb 0.16 -0.12 -0.00 0.00 0.30 0.00 0.00 27.48 27.81 3hyh h GLN 160 CO -0.18 0.37 0.01 0.82 -0.67 0.00 0.00 178.83 179.17 3hyh h ILE 161 N 0.57 1.13 -0.61 2.54 2.04 -0.79 -2.32 117.51 120.06 3hyh h ILE 161 Ca 0.22 -0.37 -0.03 0.00 1.00 0.00 0.00 64.86 65.67 3hyh h ILE 161 Cb 0.07 1.35 -0.03 0.00 -0.74 0.00 0.00 36.82 37.48 3hyh h ILE 161 CO -0.12 0.10 0.25 0.40 0.00 0.00 0.00 178.15 178.78 3hyh h ILE 162 N -0.13 1.23 -0.39 -0.67 1.08 -0.94 -0.44 117.51 117.25 3hyh h ILE 162 Ca 0.00 -0.71 0.03 0.00 -0.39 0.00 0.00 64.86 63.79 3hyh h ILE 162 Cb 0.16 0.55 -0.03 0.00 -3.07 0.00 0.00 36.82 34.42 3hyh h ILE 162 CO -0.00 0.28 0.19 -1.28 -0.69 0.00 0.00 178.15 176.65 3hyh h SER 163 N 0.86 0.27 -0.51 1.72 0.87 -1.23 0.17 113.55 115.69 3hyh h SER 163 Ca 0.21 0.02 0.03 0.00 -1.23 0.00 0.00 61.79 60.81 3hyh h SER 163 Cb 0.20 -0.03 -0.03 0.00 -0.44 0.00 0.00 62.40 62.09 3hyh h SER 163 CO -0.02 0.20 0.30 0.00 -0.53 0.00 0.00 176.83 176.78 3hyh h ALA 164 N 1.21 0.65 -0.31 6.23 0.00 -1.03 -0.67 119.26 125.34 3hyh h ALA 164 Ca 0.17 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.01 3hyh h ALA 164 Cb 0.08 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3hyh h ALA 164 CO -0.12 -0.00 -0.03 0.28 0.00 0.00 0.00 179.25 179.37 3hyh h VAL 165 N 0.59 1.27 -0.46 0.00 2.07 -0.65 -1.11 116.25 117.96 3hyh h VAL 165 Ca 0.21 -1.03 0.08 0.00 0.82 0.00 0.00 66.70 66.77 3hyh h VAL 165 Cb 0.03 1.31 -0.06 0.00 -1.52 0.00 0.00 31.29 31.05 3hyh h VAL 165 CO -0.10 0.33 0.09 -0.08 0.02 0.00 0.00 177.57 177.83 3hyh h GLU 166 N 0.36 0.22 -0.46 1.57 4.22 -0.53 0.13 114.58 120.10 3hyh h GLU 166 Ca 0.08 -0.01 0.05 0.00 0.08 0.00 0.00 59.36 59.56 3hyh h GLU 166 Cb 0.50 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.65 3hyh h GLU 166 CO 0.02 0.14 0.20 -0.92 -2.18 0.00 0.00 179.01 176.28 3hyh h TYR 167 N 0.22 0.37 -0.25 0.92 5.03 -0.88 0.12 116.97 122.51 3hyh h TYR 167 Ca 0.23 0.02 0.06 0.00 2.58 0.00 0.00 58.73 61.62 3hyh h TYR 167 Cb 0.30 -0.10 -0.06 0.00 1.55 0.00 0.00 36.73 38.42 3hyh h TYR 167 CO -0.22 0.17 -0.14 0.00 -1.32 0.00 0.00 178.16 176.65 3hyh h HIS 169 N -0.12 0.00 -0.25 0.00 3.86 -0.51 0.72 115.15 118.85 3hyh h HIS 169 Ca 0.14 0.00 -0.10 0.00 -1.16 0.00 0.00 60.37 59.25 3hyh h HIS 169 Cb 0.32 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.78 3hyh h HIS 169 CO -0.32 0.11 -0.27 -0.09 0.86 0.00 0.00 177.93 178.22 3hyh h ARG 170 N 0.00 0.49 -1.01 2.45 2.43 -0.63 -2.00 114.38 116.11 3hyh h ARG 170 Ca -0.00 -0.19 -0.54 0.00 -0.81 0.00 0.00 59.98 58.43 3hyh h ARG 170 Cb 0.75 -0.03 -0.29 0.00 -0.42 0.00 0.00 29.97 29.98 3hyh h ARG 170 CO 0.01 0.72 0.69 0.72 -1.51 0.00 0.00 179.97 180.61 3hyh n HIS 171 N -4.11 3.00 -1.25 2.20 8.25 -0.94 -4.92 115.22 117.46 3hyh n HIS 171 Ca -0.01 -2.14 -0.10 0.00 -0.26 0.00 0.00 57.72 55.21 3hyh n HIS 171 Cb 0.42 -1.07 -0.04 0.00 1.12 0.00 0.00 29.99 30.42 3hyh n HIS 171 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 3hyh n LYS 172 N -1.00 -1.36 -3.26 -0.41 4.76 -0.75 -4.92 118.16 111.22 3hyh n LYS 172 Ca 0.58 0.66 -0.41 0.00 -2.87 0.00 0.00 58.31 56.27 3hyh n LYS 172 Cb 1.34 -4.80 -0.08 0.00 -1.84 0.00 0.00 35.03 29.65 3hyh n LYS 172 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 3hyh s ILE 173 N -1.83 5.05 -0.22 -0.18 1.01 0.20 -4.95 121.20 120.28 3hyh s ILE 173 Ca 0.00 0.48 -0.09 0.00 0.00 0.00 0.00 60.65 61.04 3hyh s ILE 173 Cb 0.00 -3.90 -0.04 0.00 0.01 0.00 0.00 42.46 38.52 3hyh s ILE 173 CO 0.00 -0.11 0.11 -0.69 0.00 0.00 0.00 174.94 174.26 3hyh s VAL 174 N 2.34 5.02 -0.03 2.92 1.01 -1.26 -3.05 120.40 127.35 3hyh s VAL 174 Ca 0.19 0.06 -0.25 0.00 0.00 0.00 0.00 61.98 61.97 3hyh s VAL 174 Cb -0.16 -3.32 -0.20 0.00 0.00 0.00 0.00 36.38 32.70 3hyh s VAL 174 CO 0.12 0.39 1.20 -0.74 0.00 0.00 0.00 175.10 176.06 3hyh h HIS 175 N 7.32 0.09 0.00 5.22 2.76 -1.96 -3.47 115.15 125.12 3hyh h HIS 175 Ca -0.38 -0.03 0.00 0.00 -2.20 0.00 0.00 60.37 57.76 3hyh h HIS 175 Cb 1.17 -0.02 0.00 0.00 1.55 0.00 0.00 27.41 30.11 3hyh h HIS 175 CO 0.63 0.63 0.00 0.54 -1.30 0.00 0.00 177.93 178.43 3hyh n ARG 176 N -4.75 0.00 -1.00 5.26 1.74 -1.26 -4.63 116.66 112.02 3hyh n ARG 176 Ca -0.08 0.00 0.05 0.00 -0.77 0.00 0.00 57.85 57.04 3hyh n ARG 176 Cb 0.32 -3.22 0.09 0.00 -1.02 0.00 0.00 32.46 28.62 3hyh n ARG 176 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 3hyh n ASP 177 N 0.00 1.22 -4.62 0.55 8.00 -1.26 -5.03 116.55 115.41 3hyh n ASP 177 Ca 0.00 -2.70 -0.43 0.00 0.71 0.00 0.00 54.79 52.37 3hyh n ASP 177 Cb 0.00 -0.37 -0.03 0.00 -0.02 0.00 0.00 41.12 40.70 3hyh n ASP 177 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3hyh s LEU 178 N -1.26 3.84 0.29 0.64 2.01 -1.26 -4.83 118.68 118.09 3hyh s LEU 178 Ca 0.32 1.60 -0.20 0.00 0.01 0.00 0.00 54.13 55.85 3hyh s LEU 178 Cb 0.33 -3.53 0.04 0.00 0.01 0.00 0.00 46.19 43.04 3hyh s LEU 178 CO -0.11 -1.33 0.78 -1.59 1.01 0.00 0.00 176.35 175.11 3hyh s LYS 179 N 4.84 1.81 0.29 1.70 -2.85 -1.26 -4.90 119.74 119.37 3hyh s LYS 179 Ca 0.73 -1.05 0.03 0.00 -1.00 0.00 0.00 55.97 54.69 3hyh s LYS 179 Cb -0.25 0.58 0.65 0.00 -2.06 0.00 0.00 37.83 36.75 3hyh s LYS 179 CO 0.30 -0.83 1.79 -1.35 0.10 0.00 0.00 175.35 175.36 3hyh h PRO 180 N 2.00 0.79 0.00 1.78 0.11 -1.94 -0.45 132.00 134.29 3hyh h PRO 180 Ca -0.23 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 65.83 3hyh h PRO 180 Cb 1.25 -0.18 -0.00 0.00 0.11 0.00 0.00 31.00 32.18 3hyh h PRO 180 CO 0.28 0.52 -0.03 0.93 -0.21 0.00 0.00 178.00 179.49 3hyh h GLU 181 N 0.81 0.00 0.00 1.05 3.07 -1.97 -3.09 114.58 114.45 3hyh h GLU 181 Ca 0.54 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.40 3hyh h GLU 181 Cb 0.73 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.64 3hyh h GLU 181 CO -0.34 0.03 -1.29 0.09 -1.40 0.00 0.00 179.01 176.10 3hyh n ASN 182 N -3.17 0.66 -4.18 1.42 4.13 -0.20 -4.74 115.26 109.19 3hyh n ASN 182 Ca -0.00 -0.62 -0.40 0.00 1.68 0.00 0.00 54.58 55.24 3hyh n ASN 182 Cb 0.28 1.26 -0.06 0.00 -1.54 0.00 0.00 39.78 39.72 3hyh n ASN 182 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 3hyh s LEU 183 N -3.53 5.79 0.49 3.41 1.43 -1.09 -0.93 118.68 124.25 3hyh s LEU 183 Ca 0.03 -3.12 -0.04 0.00 -1.03 0.00 0.00 54.13 49.96 3hyh s LEU 183 Cb 0.15 -1.99 -0.03 0.00 0.03 0.00 0.00 46.19 44.36 3hyh s LEU 183 CO 0.87 -0.36 0.78 -0.76 0.23 0.00 0.00 176.35 177.12 3hyh s LEU 184 N -0.47 3.58 -0.05 1.79 1.43 -0.68 -0.24 118.68 124.04 3hyh s LEU 184 Ca 0.21 0.81 0.04 0.00 -1.03 0.00 0.00 54.13 54.17 3hyh s LEU 184 Cb -0.13 -3.73 -0.00 0.00 0.03 0.00 0.00 46.19 42.36 3hyh s LEU 184 CO -0.07 -0.66 -0.18 -0.76 0.23 0.00 0.00 176.35 174.90 3hyh s LEU 185 N -4.74 1.93 0.00 1.79 1.43 0.23 -0.59 118.68 118.72 3hyh s LEU 185 Ca 0.48 -0.38 -0.08 0.00 -1.03 0.00 0.00 54.13 53.12 3hyh s LEU 185 Cb -0.10 -1.05 0.14 0.00 0.03 0.00 0.00 46.19 45.21 3hyh s LEU 185 CO 0.44 0.16 0.84 -0.90 0.23 0.00 0.00 176.35 177.12 3hyh n ASP 186 N 3.17 0.32 0.00 2.29 3.85 -0.88 -2.87 116.55 122.44 3hyh n ASP 186 Ca -0.18 -1.46 0.04 0.00 -0.71 0.00 0.00 54.79 52.48 3hyh n ASP 186 Cb 0.53 -0.62 0.21 0.00 -1.35 0.00 0.00 41.12 39.89 3hyh n ASP 186 CO 0.00 0.00 0.00 -1.84 -1.01 0.00 0.00 177.20 174.35 3hyh n GLU 187 N -2.72 0.11 -0.37 0.11 0.28 -1.26 -2.59 120.64 114.21 3hyh n GLU 187 Ca 0.11 0.21 0.08 0.00 -0.16 0.00 0.00 57.16 57.41 3hyh n GLU 187 Cb 0.40 -1.50 0.23 0.00 1.43 0.00 0.00 31.44 32.00 3hyh n GLU 187 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 3hyh n HIS 188 N -1.30 0.79 -2.91 -1.84 8.25 -1.26 -4.95 115.22 112.00 3hyh n HIS 188 Ca 0.04 -0.80 -0.21 0.00 -0.26 0.00 0.00 57.72 56.49 3hyh n HIS 188 Cb 0.07 -0.25 0.02 0.00 1.12 0.00 0.00 29.99 30.95 3hyh n HIS 188 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 3hyh n LEU 189 N -0.34 -2.18 -4.72 2.41 4.77 -1.07 -4.99 117.00 110.88 3hyh n LEU 189 Ca 0.19 -0.20 -0.36 0.00 -0.03 0.00 0.00 56.01 55.60 3hyh n LEU 189 Cb 0.78 -2.73 -0.07 0.00 -2.33 0.00 0.00 43.42 39.06 3hyh n LEU 189 CO 0.13 0.10 -0.04 0.20 -1.33 0.00 0.00 177.39 176.45 3hyh s ASN 190 N -2.51 6.38 0.30 -1.43 0.01 -1.26 -4.94 114.94 111.49 3hyh s ASN 190 Ca 0.23 0.44 -0.29 0.00 -0.71 0.00 0.00 52.86 52.53 3hyh s ASN 190 Cb -0.11 -2.17 -0.10 0.00 0.41 0.00 0.00 41.25 39.28 3hyh s ASN 190 CO 0.29 0.09 1.30 -0.69 -1.51 0.00 0.00 177.10 176.58 3hyh s VAL 191 N 0.58 2.84 -0.21 1.60 1.01 -1.26 -2.07 120.40 122.89 3hyh s VAL 191 Ca 0.15 0.81 -0.02 0.00 0.00 0.00 0.00 61.98 62.91 3hyh s VAL 191 Cb -0.13 -3.51 0.06 0.00 0.00 0.00 0.00 36.38 32.80 3hyh s VAL 191 CO 0.03 0.18 0.03 -0.54 0.00 0.00 0.00 175.10 174.80 3hyh s LYS 192 N -1.41 0.73 0.10 2.72 -0.14 0.24 -4.31 119.74 117.67 3hyh s LYS 192 Ca 0.50 -0.51 -0.31 0.00 -1.36 0.00 0.00 55.97 54.29 3hyh s LYS 192 Cb -0.39 -2.13 -0.08 0.00 -1.68 0.00 0.00 37.83 33.54 3hyh s LYS 192 CO 0.49 -0.67 1.49 0.42 -0.76 0.00 0.00 175.35 176.33 3hyh s ILE 193 N 1.81 3.12 -0.05 2.17 1.01 0.18 -1.69 121.20 127.74 3hyh s ILE 193 Ca -0.01 0.73 0.15 0.00 0.00 0.00 0.00 60.65 61.53 3hyh s ILE 193 Cb -0.17 -3.47 -0.23 0.00 0.01 0.00 0.00 42.46 38.59 3hyh s ILE 193 CO -0.09 0.04 0.35 0.00 0.00 0.00 0.00 174.94 175.23 3hyh n ALA 194 N 4.46 2.63 0.00 9.38 0.00 -0.11 -0.71 120.51 136.16 3hyh n ALA 194 Ca 0.13 -0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.21 3hyh n ALA 194 Cb 0.41 -0.52 0.00 0.00 0.00 0.00 0.00 19.45 19.34 3hyh n ALA 194 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3hyh n ASP 195 N -2.00 0.01 0.00 0.00 -0.08 -1.26 -4.89 116.55 108.32 3hyh n ASP 195 Ca -0.03 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.25 3hyh n ASP 195 Cb 0.39 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.85 3hyh n ASP 195 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 3hyh n PHE 196 N -2.64 0.00 0.00 -0.67 3.01 -1.26 -4.25 117.46 111.66 3hyh n PHE 196 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 3hyh n PHE 196 Cb 0.14 -0.63 0.00 0.00 -0.01 0.00 0.00 39.48 38.98 3hyh n PHE 196 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3hyh n GLY 197 N -1.88 1.16 3.41 1.37 0.00 -1.26 -4.86 105.19 103.13 3hyh n GLY 197 Ca 0.00 -0.02 -0.44 0.00 0.00 0.00 0.00 46.02 45.56 3hyh n GLY 197 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hyh s LEU 198 N 0.00 5.05 0.00 0.99 1.43 -1.26 -5.09 118.68 119.80 3hyh s LEU 198 Ca 0.00 -1.40 0.00 0.00 -1.03 0.00 0.00 54.13 51.70 3hyh s LEU 198 Cb 0.00 -2.35 0.00 0.00 0.03 0.00 0.00 46.19 43.87 3hyh s LEU 198 CO 0.00 -1.20 0.00 -1.20 0.23 0.00 0.00 176.35 174.18 3hyh n SER 199 N 6.75 0.00 -0.01 2.29 7.64 -1.26 -4.89 113.62 124.14 3hyh n SER 199 Ca -0.03 0.00 0.08 0.00 1.01 0.00 0.00 58.87 59.93 3hyh n SER 199 Cb 0.44 0.00 -0.14 0.00 -1.01 0.00 0.00 64.21 63.51 3hyh n SER 199 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 3hyh n PRO 215 N 0.00 0.61 0.18 1.43 -0.04 -1.26 -5.10 135.00 130.81 3hyh n PRO 215 Ca 0.00 -0.15 0.13 0.00 -0.04 0.00 0.00 63.50 63.44 3hyh n PRO 215 Cb 0.00 -1.43 0.64 0.00 -0.04 0.00 0.00 33.50 32.68 3hyh n PRO 215 CO 0.00 0.00 0.00 -0.91 -0.04 0.00 0.00 175.50 174.55 3hyh h ASN 216 N 0.00 0.00 -0.00 3.54 2.35 -1.99 -2.19 115.58 117.28 3hyh h ASN 216 Ca -0.04 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.71 3hyh h ASN 216 Cb 0.92 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.29 3hyh h ASN 216 CO 0.00 0.00 -0.53 -1.22 -1.65 0.00 0.00 177.43 174.03 3hyh n TYR 217 N -2.36 0.00 -2.79 1.19 4.01 -1.26 -4.83 117.16 111.12 3hyh n TYR 217 Ca -0.01 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.32 3hyh n TYR 217 Cb 0.08 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.07 3hyh n TYR 217 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3hyh s ALA 218 N -2.10 3.24 0.78 -0.72 0.00 -0.83 -4.05 121.76 118.08 3hyh s ALA 218 Ca 0.07 0.49 -0.13 0.00 0.00 0.00 0.00 51.96 52.38 3hyh s ALA 218 Cb 0.11 -3.23 0.07 0.00 0.00 0.00 0.00 23.12 20.06 3hyh s ALA 218 CO 0.49 -0.08 1.19 0.00 0.00 0.00 0.00 175.76 177.36 3hyh s ALA 219 N 0.37 1.97 0.29 0.00 0.00 -1.26 -4.86 121.76 118.26 3hyh s ALA 219 Ca 0.46 0.78 0.02 0.00 0.00 0.00 0.00 51.96 53.22 3hyh s ALA 219 Cb -0.22 -3.45 0.57 0.00 0.00 0.00 0.00 23.12 20.02 3hyh s ALA 219 CO 0.27 -2.09 1.84 -1.35 0.00 0.00 0.00 175.76 174.43 3hyh h PRO 220 N -0.73 0.95 0.00 0.00 0.11 -1.86 -1.14 132.00 129.32 3hyh h PRO 220 Ca -0.46 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.59 3hyh h PRO 220 Cb 1.29 -0.22 0.00 0.00 0.11 0.00 0.00 31.00 32.18 3hyh h PRO 220 CO 0.48 0.63 0.00 -0.85 -0.21 0.00 0.00 178.00 178.05 3hyh n GLU 221 N -4.61 0.18 0.02 1.05 0.00 -1.26 -2.40 120.64 113.63 3hyh n GLU 221 Ca 0.19 0.33 -0.09 0.00 0.00 0.00 0.00 57.16 57.59 3hyh n GLU 221 Cb 0.36 -1.80 -0.13 0.00 0.00 0.00 0.00 31.44 29.87 3hyh n GLU 221 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.13 177.41 3hyh h VAL 222 N 0.00 1.25 0.13 3.84 2.07 -1.57 -3.37 116.25 118.61 3hyh h VAL 222 Ca 0.00 -3.02 -0.19 0.00 0.82 0.00 0.00 66.70 64.31 3hyh h VAL 222 Cb 0.45 2.63 0.02 0.00 -1.52 0.00 0.00 31.29 32.87 3hyh h VAL 222 CO 0.00 0.73 -0.83 0.40 0.02 0.00 0.00 177.57 177.89 3hyh h ILE 223 N 0.01 1.49 0.04 4.57 2.04 -1.24 -3.49 117.51 120.93 3hyh h ILE 223 Ca -0.16 -2.51 -0.10 0.00 1.00 0.00 0.00 64.86 63.09 3hyh h ILE 223 Cb 1.91 3.14 0.01 0.00 -0.74 0.00 0.00 36.82 41.14 3hyh h ILE 223 CO 0.11 0.71 -0.40 0.77 0.00 0.00 0.00 178.15 179.34 3hyh h SER 224 N -0.32 0.29 -3.08 1.72 4.64 -1.65 -3.52 113.55 111.64 3hyh h SER 224 Ca -0.14 -0.86 0.17 0.00 -0.47 0.00 0.00 61.79 60.49 3hyh h SER 224 Cb 1.64 -0.09 -0.04 0.00 -0.31 0.00 0.00 62.40 63.60 3hyh h SER 224 CO 0.16 1.12 -0.23 0.61 -0.87 0.00 0.00 176.83 177.62 3hyh n GLY 230 N 1.31 -1.82 0.30 -0.77 0.00 -1.26 -4.90 105.19 98.06 3hyh n GLY 230 Ca -0.11 -1.25 0.20 0.00 0.00 0.00 0.00 46.02 44.86 3hyh n GLY 230 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3hyh h PRO 231 N 0.00 0.00 0.00 1.61 0.13 -1.99 -1.48 132.00 130.27 3hyh h PRO 231 Ca 0.01 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.14 3hyh h PRO 231 Cb 0.58 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.71 3hyh h PRO 231 CO 0.00 0.00 -0.01 0.93 -0.23 0.00 0.00 178.00 178.69 3hyh h GLU 232 N 0.00 0.00 -0.53 0.86 3.07 -1.96 -1.96 114.58 114.07 3hyh h GLU 232 Ca 0.00 0.00 -0.03 0.00 -0.50 0.00 0.00 59.36 58.83 3hyh h GLU 232 Cb 0.02 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 27.90 3hyh h GLU 232 CO 0.00 0.01 0.22 -0.24 -1.40 0.00 0.00 179.01 177.61 3hyh h VAL 233 N 0.00 1.19 -0.03 3.13 3.04 -1.70 -2.65 116.25 119.24 3hyh h VAL 233 Ca -0.00 -0.58 -0.19 0.00 -1.01 0.00 0.00 66.70 64.92 3hyh h VAL 233 Cb 0.12 0.55 -0.01 0.00 -2.01 0.00 0.00 31.29 29.94 3hyh h VAL 233 CO 0.00 0.23 -0.80 0.44 -1.01 0.00 0.00 177.57 176.44 3hyh h ASP 234 N 0.76 0.33 -0.20 3.17 3.32 -1.56 -2.54 116.42 119.69 3hyh h ASP 234 Ca 0.18 -0.24 -0.00 0.00 0.02 0.00 0.00 57.03 57.00 3hyh h ASP 234 Cb 0.13 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 3hyh h ASP 234 CO -0.02 1.00 0.13 0.58 -1.72 0.00 0.00 179.24 179.20 3hyh h VAL 235 N 0.16 1.08 -0.23 -1.35 2.07 -1.50 0.11 116.25 116.60 3hyh h VAL 235 Ca -0.04 -0.19 -0.00 0.00 0.82 0.00 0.00 66.70 67.29 3hyh h VAL 235 Cb 1.39 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 31.98 3hyh h VAL 235 CO 0.13 0.08 0.13 -0.25 0.02 0.00 0.00 177.57 177.67 3hyh h TRP 236 N 0.25 0.31 -0.90 1.57 2.91 -1.45 -0.29 115.95 118.36 3hyh h TRP 236 Ca 0.07 -0.00 0.04 0.00 1.13 0.00 0.00 58.89 60.13 3hyh h TRP 236 Cb 0.01 -0.10 -0.05 0.00 -0.51 0.00 0.00 29.16 28.51 3hyh h TRP 236 CO -0.05 0.26 0.58 0.77 -1.03 0.00 0.00 178.44 178.96 3hyh h SER 237 N 0.27 0.96 0.08 2.65 0.02 -1.25 -0.84 113.55 115.44 3hyh h SER 237 Ca 0.08 -0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 60.94 3hyh h SER 237 Cb 0.04 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.36 3hyh h SER 237 CO -0.01 0.65 -0.29 0.00 -1.14 0.00 0.00 176.83 176.04 3hyh h GLY 239 N 1.04 0.55 0.96 0.00 0.00 -0.05 0.11 103.07 105.68 3hyh h GLY 239 Ca 0.04 -0.21 -0.03 0.00 0.00 0.00 0.00 47.33 47.13 3hyh h GLY 239 CO 0.05 0.20 0.16 -2.08 0.00 0.00 0.00 176.54 174.87 3hyh h VAL 240 N 0.53 1.22 -0.10 4.60 2.07 -0.91 -1.64 116.25 122.01 3hyh h VAL 240 Ca 0.14 -0.71 0.00 0.00 0.82 0.00 0.00 66.70 66.96 3hyh h VAL 240 Cb -0.05 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 30.53 3hyh h VAL 240 CO -0.03 0.26 0.07 0.40 0.02 0.00 0.00 177.57 178.28 3hyh h ILE 241 N 0.60 1.02 -0.57 4.57 2.04 -0.90 -1.44 117.51 122.83 3hyh h ILE 241 Ca 0.15 -0.05 0.08 0.00 1.00 0.00 0.00 64.86 66.05 3hyh h ILE 241 Cb 0.24 0.87 -0.07 0.00 -0.74 0.00 0.00 36.82 37.13 3hyh h ILE 241 CO -0.01 0.02 0.22 0.25 0.00 0.00 0.00 178.15 178.64 3hyh h LEU 242 N 0.14 0.23 0.05 1.44 5.85 -0.71 -1.65 115.31 120.66 3hyh h LEU 242 Ca 0.04 0.07 0.02 0.00 0.84 0.00 0.00 57.88 58.84 3hyh h LEU 242 Cb -0.01 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.03 3hyh h LEU 242 CO -0.01 0.15 -0.16 0.22 -0.34 0.00 0.00 178.44 178.30 3hyh h TYR 243 N 0.41 -0.41 -0.89 1.25 3.20 -1.00 -1.42 116.97 118.11 3hyh h TYR 243 Ca 0.28 0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.19 3hyh h TYR 243 Cb 0.32 0.18 -0.05 0.00 1.54 0.00 0.00 36.73 38.71 3hyh h TYR 243 CO -0.16 -0.23 0.58 0.28 -1.64 0.00 0.00 178.16 176.98 3hyh h VAL 244 N -0.29 1.15 -0.43 1.81 2.07 -0.85 0.26 116.25 119.97 3hyh h VAL 244 Ca 0.04 -0.38 -0.09 0.00 0.82 0.00 0.00 66.70 67.08 3hyh h VAL 244 Cb 0.33 -0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 30.01 3hyh h VAL 244 CO -0.12 0.20 -0.11 0.24 0.02 0.00 0.00 177.57 177.81 3hyh h MET 245 N 1.12 0.78 0.12 1.57 2.86 -1.13 0.73 114.93 120.97 3hyh h MET 245 Ca 0.35 -0.26 -0.29 0.00 -2.06 0.00 0.00 59.70 57.45 3hyh h MET 245 Cb -0.00 -0.06 0.02 0.00 0.06 0.00 0.00 31.60 31.61 3hyh h MET 245 CO -0.12 0.86 -1.22 -0.07 1.06 0.00 0.00 176.91 177.42 3hyh h LEU 246 N 0.70 0.72 -0.20 1.22 -0.00 -0.64 -3.39 115.31 113.73 3hyh h LEU 246 Ca 0.12 -0.68 0.00 0.00 -0.00 0.00 0.00 57.88 57.32 3hyh h LEU 246 Cb 0.59 -0.23 0.00 0.00 -0.00 0.00 0.00 40.66 41.02 3hyh h LEU 246 CO 0.04 1.50 -0.34 0.00 -0.00 0.00 0.00 178.44 179.64 3hyh n ARG 248 N -0.95 -6.17 -3.51 0.00 0.63 0.25 -4.96 116.66 101.95 3hyh n ARG 248 Ca 0.02 0.72 -0.17 0.00 -0.92 0.00 0.00 57.85 57.50 3hyh n ARG 248 Cb 0.15 -5.66 -0.05 0.00 0.45 0.00 0.00 32.46 27.34 3hyh n ARG 248 CO 0.00 0.00 0.00 0.50 -2.51 0.00 0.00 177.63 175.62 3hyh s ARG 249 N -6.32 1.08 0.06 -0.14 6.06 -1.25 -5.08 118.95 113.37 3hyh s ARG 249 Ca 0.56 0.15 -0.28 0.00 -2.50 0.00 0.00 55.73 53.66 3hyh s ARG 249 Cb -0.27 0.51 -0.05 0.00 0.06 0.00 0.00 34.95 35.20 3hyh s ARG 249 CO 0.70 -0.36 0.88 -0.51 -2.50 0.00 0.00 175.30 173.51 3hyh s LEU 250 N -1.42 4.45 0.29 -0.88 1.43 -1.26 -3.79 118.68 117.49 3hyh s LEU 250 Ca -0.09 1.62 0.04 0.00 -1.03 0.00 0.00 54.13 54.67 3hyh s LEU 250 Cb -0.00 -3.44 0.45 0.00 0.03 0.00 0.00 46.19 43.23 3hyh s LEU 250 CO 0.06 -0.07 1.73 1.55 0.23 0.00 0.00 176.35 179.85 3hyh h PRO 251 N 5.87 0.41 0.00 1.29 0.13 -1.93 -3.35 132.00 134.43 3hyh h PRO 251 Ca -0.43 -0.16 0.00 0.00 -0.87 0.00 0.00 66.00 64.54 3hyh h PRO 251 Cb 1.21 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.32 3hyh h PRO 251 CO 0.72 0.66 -0.70 1.19 -0.23 0.00 0.00 178.00 179.64 3hyh n PHE 252 N -4.11 0.00 -1.73 1.56 3.01 -1.26 -4.54 117.46 110.38 3hyh n PHE 252 Ca -0.01 0.00 -0.41 0.00 1.01 0.00 0.00 57.45 58.05 3hyh n PHE 252 Cb 0.41 -0.01 0.01 0.00 -0.01 0.00 0.00 39.48 39.88 3hyh n PHE 252 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 3hyh n ASP 253 N -1.35 3.01 -3.61 4.37 2.03 -1.26 -4.72 116.55 115.03 3hyh n ASP 253 Ca 0.03 1.14 -0.16 0.00 0.52 0.00 0.00 54.79 56.31 3hyh n ASP 253 Cb 0.23 -1.55 -0.07 0.00 -0.72 0.00 0.00 41.12 39.00 3hyh n ASP 253 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 3hyh s ASP 254 N -0.44 -0.54 0.55 1.67 -1.08 -1.26 -4.98 116.67 110.60 3hyh s ASP 254 Ca 0.59 0.65 0.33 0.00 -0.52 0.00 0.00 52.55 53.61 3hyh s ASP 254 Cb -0.49 0.60 1.50 0.00 -1.46 0.00 0.00 42.92 43.07 3hyh s ASP 254 CO 0.59 -0.50 2.04 -0.33 0.52 0.00 0.00 175.17 177.49 3hyh h GLU 255 N 3.59 0.00 -5.26 4.34 5.08 -2.00 -3.43 114.58 116.90 3hyh h GLU 255 Ca -0.28 0.00 -0.62 0.00 -1.00 0.00 0.00 59.36 57.46 3hyh h GLU 255 Cb 1.15 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 30.27 3hyh h GLU 255 CO 0.35 0.05 -0.16 0.45 -1.00 0.00 0.00 179.01 178.70 3hyh s SER 256 N -5.74 6.34 0.09 1.42 0.15 -1.26 -5.01 113.70 109.69 3hyh s SER 256 Ca -0.01 0.40 -0.32 0.00 0.70 0.00 0.00 55.95 56.73 3hyh s SER 256 Cb 0.10 -2.24 -0.14 0.00 -1.71 0.00 0.00 66.02 62.04 3hyh s SER 256 CO 0.54 -0.20 1.50 0.40 1.20 0.00 0.00 173.24 176.68 3hyh h ILE 257 N 5.34 0.00 -0.72 6.45 2.04 -2.00 0.30 117.51 128.92 3hyh h ILE 257 Ca -0.31 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.60 3hyh h ILE 257 Cb 1.15 0.00 -0.04 0.00 -0.74 0.00 0.00 36.82 37.19 3hyh h ILE 257 CO 0.68 0.00 0.48 1.55 0.00 0.00 0.00 178.15 180.85 3hyh h PRO 258 N -0.76 0.79 -0.27 2.37 0.13 -1.97 -2.17 132.00 130.12 3hyh h PRO 258 Ca -0.02 -0.05 -0.01 0.00 -0.87 0.00 0.00 66.00 65.05 3hyh h PRO 258 Cb 0.72 -0.18 -0.01 0.00 0.13 0.00 0.00 31.00 31.66 3hyh h PRO 258 CO -0.20 0.52 0.14 0.28 -0.23 0.00 0.00 178.00 178.51 3hyh h VAL 259 N 0.81 1.13 -0.03 1.56 2.07 -1.87 0.07 116.25 119.99 3hyh h VAL 259 Ca 0.30 -0.35 0.03 0.00 0.82 0.00 0.00 66.70 67.50 3hyh h VAL 259 Cb 0.16 0.87 -0.05 0.00 -1.52 0.00 0.00 31.29 30.76 3hyh h VAL 259 CO -0.09 0.13 -0.24 0.25 0.02 0.00 0.00 177.57 177.64 3hyh h LEU 260 N 0.32 -0.71 -1.10 2.57 5.85 -0.52 0.15 115.31 121.87 3hyh h LEU 260 Ca 0.09 0.10 -0.05 0.00 0.84 0.00 0.00 57.88 58.87 3hyh h LEU 260 Cb 0.08 0.30 -0.02 0.00 0.37 0.00 0.00 40.66 41.39 3hyh h LEU 260 CO -0.01 -0.30 0.09 -0.26 -0.34 0.00 0.00 178.44 177.62 3hyh h PHE 261 N -0.35 0.76 -0.17 1.25 0.04 -1.27 -2.25 116.94 114.94 3hyh h PHE 261 Ca 0.07 -0.07 -0.00 0.00 2.80 0.00 0.00 57.97 60.77 3hyh h PHE 261 Cb 0.45 -0.22 -0.01 0.00 2.20 0.00 0.00 35.95 38.37 3hyh h PHE 261 CO -0.29 0.66 0.10 -0.22 -0.60 0.00 0.00 178.31 177.96 3hyh h LYS 262 N 0.71 0.23 -0.38 1.51 3.64 -0.59 -0.53 116.57 121.16 3hyh h LYS 262 Ca 0.16 -0.02 0.08 0.00 -1.27 0.00 0.00 60.65 59.59 3hyh h LYS 262 Cb 0.30 -0.05 -0.07 0.00 -0.41 0.00 0.00 32.23 32.00 3hyh h LYS 262 CO 0.00 0.19 -0.09 -0.91 -2.27 0.00 0.00 179.45 176.37 3hyh h ASN 263 N 0.20 -0.35 0.21 4.20 2.35 -0.38 -0.59 115.58 121.22 3hyh h ASN 263 Ca 0.06 0.11 -0.01 0.00 -0.55 0.00 0.00 56.30 55.91 3hyh h ASN 263 Cb 0.02 0.23 0.00 0.00 0.05 0.00 0.00 38.32 38.63 3hyh h ASN 263 CO -0.01 -0.12 -0.10 0.40 -1.65 0.00 0.00 177.43 175.94 3hyh h ILE 264 N -0.00 0.87 -0.23 2.81 2.04 -1.30 0.18 117.51 121.88 3hyh h ILE 264 Ca 0.18 -0.43 0.03 0.00 1.00 0.00 0.00 64.86 65.64 3hyh h ILE 264 Cb 0.28 1.12 -0.01 0.00 -0.74 0.00 0.00 36.82 37.47 3hyh h ILE 264 CO -0.39 0.10 0.15 0.77 0.00 0.00 0.00 178.15 178.78 3hyh h SER 265 N -0.49 0.17 -0.01 1.72 4.64 -1.01 -1.89 113.55 116.67 3hyh h SER 265 Ca -0.03 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 3hyh h SER 265 Cb 0.37 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.42 3hyh h SER 265 CO 0.05 0.12 -0.13 0.59 -0.87 0.00 0.00 176.83 176.58 3hyh n ASN 266 N -4.50 2.45 -3.45 4.97 5.03 -0.24 -4.96 115.26 114.57 3hyh n ASN 266 Ca 0.01 -1.75 -0.24 0.00 0.87 0.00 0.00 54.58 53.47 3hyh n ASN 266 Cb 0.16 0.12 0.07 0.00 -1.02 0.00 0.00 39.78 39.11 3hyh n ASN 266 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3hyh n GLY 267 N 1.34 -0.54 3.54 7.41 0.00 0.35 -4.96 105.19 112.33 3hyh n GLY 267 Ca 0.13 0.22 -0.42 0.00 0.00 0.00 0.00 46.02 45.96 3hyh n GLY 267 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hyh s VAL 268 N -3.28 4.97 0.15 1.61 1.01 0.28 -5.02 120.40 120.12 3hyh s VAL 268 Ca 0.51 0.27 -0.24 0.00 0.00 0.00 0.00 61.98 62.53 3hyh s VAL 268 Cb -0.23 -4.04 0.07 0.00 0.00 0.00 0.00 36.38 32.19 3hyh s VAL 268 CO 0.64 -0.33 0.66 -0.72 0.00 0.00 0.00 175.10 175.34 3hyh s TYR 269 N 2.50 -0.47 -0.13 5.22 -0.85 -1.26 -4.73 117.35 117.63 3hyh s TYR 269 Ca 0.20 0.25 -0.09 0.00 -0.52 0.00 0.00 57.07 56.90 3hyh s TYR 269 Cb -0.15 0.57 -0.04 0.00 0.38 0.00 0.00 41.96 42.72 3hyh s TYR 269 CO 0.15 -0.85 0.17 0.99 -1.52 0.00 0.00 175.55 174.49 3hyh s THR 270 N -3.68 5.43 -0.45 -3.49 2.01 -1.26 -5.08 115.64 109.13 3hyh s THR 270 Ca 0.03 0.28 -0.15 0.00 0.31 0.00 0.00 61.69 62.15 3hyh s THR 270 Cb -0.02 -3.46 0.05 0.00 0.01 0.00 0.00 72.50 69.09 3hyh s THR 270 CO -0.10 0.56 0.36 -0.76 -0.69 0.00 0.00 174.62 173.99 3hyh s LEU 271 N -0.63 5.41 0.78 4.42 1.43 -1.26 -4.98 118.68 123.85 3hyh s LEU 271 Ca 0.14 -1.15 -0.14 0.00 -1.03 0.00 0.00 54.13 51.95 3hyh s LEU 271 Cb -0.12 -2.17 0.04 0.00 0.03 0.00 0.00 46.19 43.96 3hyh s LEU 271 CO 0.03 -0.56 0.98 -2.65 0.23 0.00 0.00 176.35 174.38 3hyh n PRO 272 N 5.19 0.27 0.01 1.29 -0.02 -1.26 -4.96 135.00 135.52 3hyh n PRO 272 Ca -0.12 0.16 -0.07 0.00 -2.02 0.00 0.00 63.50 61.45 3hyh n PRO 272 Cb 0.45 -2.25 0.11 0.00 -0.02 0.00 0.00 33.50 31.79 3hyh n PRO 272 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 3hyh h LYS 273 N -0.67 0.51 0.00 -0.52 1.57 -2.03 -3.09 116.57 112.34 3hyh h LYS 273 Ca -0.46 -0.28 0.00 0.00 -1.87 0.00 0.00 60.65 58.04 3hyh h LYS 273 Cb 1.31 0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.64 3hyh h LYS 273 CO 0.45 0.86 0.00 1.97 -0.57 0.00 0.00 179.45 182.16 3hyh n PHE 274 N -4.00 0.65 -2.21 -1.35 1.16 -1.26 -4.80 117.46 105.65 3hyh n PHE 274 Ca -0.02 0.29 -0.40 0.00 -1.87 0.00 0.00 57.45 55.44 3hyh n PHE 274 Cb 0.54 -0.96 -0.03 0.00 -1.61 0.00 0.00 39.48 37.42 3hyh n PHE 274 CO 0.00 0.00 0.00 -1.17 -1.87 0.00 0.00 176.76 173.72 3hyh s LEU 275 N -4.25 4.44 0.62 5.98 2.96 -1.17 -5.02 118.68 122.24 3hyh s LEU 275 Ca 0.02 2.57 -0.16 0.00 -0.22 0.00 0.00 54.13 56.35 3hyh s LEU 275 Cb 0.08 -3.66 -0.02 0.00 0.50 0.00 0.00 46.19 43.08 3hyh s LEU 275 CO 0.29 -0.45 1.08 -0.94 -1.32 0.00 0.00 176.35 175.01 3hyh s SER 276 N -0.61 5.50 0.45 3.68 1.04 -1.26 -4.85 113.70 117.63 3hyh s SER 276 Ca 0.48 1.91 0.10 0.00 0.48 0.00 0.00 55.95 58.92 3hyh s SER 276 Cb -0.37 -2.54 1.00 0.00 0.10 0.00 0.00 66.02 64.20 3hyh s SER 276 CO 0.49 -1.36 2.08 1.55 0.98 0.00 0.00 173.24 176.98 3hyh h PRO 277 N 0.29 0.36 0.27 4.02 0.13 -1.97 -1.04 132.00 134.06 3hyh h PRO 277 Ca -0.47 -0.02 -0.01 0.00 -0.87 0.00 0.00 66.00 64.63 3hyh h PRO 277 Cb 1.23 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.28 3hyh h PRO 277 CO 0.56 0.24 -0.13 0.78 -0.23 0.00 0.00 178.00 179.22 3hyh h GLY 278 N 0.37 -0.38 0.74 1.56 0.00 -1.99 -1.84 103.07 101.54 3hyh h GLY 278 Ca 0.11 0.14 -0.00 0.00 0.00 0.00 0.00 47.33 47.58 3hyh h GLY 278 CO -0.02 -0.14 -0.01 0.00 0.00 0.00 0.00 176.54 176.37 3hyh h ALA 279 N 0.27 -0.02 -0.73 3.60 0.00 -1.89 -2.52 119.26 117.98 3hyh h ALA 279 Ca -0.04 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 3hyh h ALA 279 Cb 0.33 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 3hyh h ALA 279 CO 0.06 -0.38 0.39 0.00 0.00 0.00 0.00 179.25 179.32 3hyh h ALA 280 N 0.71 0.93 -0.75 0.00 0.00 -1.29 -0.44 119.26 118.43 3hyh h ALA 280 Ca -0.00 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 3hyh h ALA 280 Cb 0.26 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 3hyh h ALA 280 CO 0.00 0.46 0.35 0.78 0.00 0.00 0.00 179.25 180.84 3hyh h GLY 281 N 1.01 1.15 0.54 0.00 0.00 -1.33 0.11 103.07 104.54 3hyh h GLY 281 Ca 0.25 -0.57 -0.05 0.00 0.00 0.00 0.00 47.33 46.97 3hyh h GLY 281 CO -0.04 0.54 -0.16 -2.00 0.00 0.00 0.00 176.54 174.88 3hyh h LEU 282 N 1.06 0.22 -0.49 3.11 5.85 -1.18 -2.90 115.31 120.98 3hyh h LEU 282 Ca 0.26 -0.64 0.10 0.00 0.84 0.00 0.00 57.88 58.44 3hyh h LEU 282 Cb 0.13 -0.06 -0.09 0.00 0.37 0.00 0.00 40.66 41.00 3hyh h LEU 282 CO -0.03 0.82 -0.07 0.40 -0.34 0.00 0.00 178.44 179.21 3hyh h ILE 283 N -0.37 0.55 -0.40 4.05 2.04 -1.00 -2.06 117.51 120.32 3hyh h ILE 283 Ca -0.01 -0.01 0.01 0.00 1.00 0.00 0.00 64.86 65.85 3hyh h ILE 283 Cb 0.80 0.50 -0.02 0.00 -0.74 0.00 0.00 36.82 37.36 3hyh h ILE 283 CO 0.03 0.01 0.27 0.50 0.00 0.00 0.00 178.15 178.96 3hyh h LYS 284 N 0.04 0.49 0.00 2.37 3.64 -0.78 -0.66 116.57 121.67 3hyh h LYS 284 Ca 0.24 -0.03 -0.07 0.00 -1.27 0.00 0.00 60.65 59.52 3hyh h LYS 284 Cb 0.37 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.07 3hyh h LYS 284 CO -0.47 0.32 -0.45 0.00 -2.27 0.00 0.00 179.45 176.58 3hyh h ARG 285 N 0.50 0.00 0.09 1.90 3.08 -1.25 -3.30 114.38 115.41 3hyh h ARG 285 Ca 0.15 0.00 -0.26 0.00 0.07 0.00 0.00 59.98 59.95 3hyh h ARG 285 Cb 0.01 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 3hyh h ARG 285 CO -0.04 0.31 -1.19 0.52 -1.07 0.00 0.00 179.97 178.51 3hyh h MET 286 N 0.00 0.20 -2.02 0.04 2.86 -0.48 -2.70 114.93 112.82 3hyh h MET 286 Ca -0.02 -0.34 -0.62 0.00 -2.06 0.00 0.00 59.70 56.67 3hyh h MET 286 Cb 1.27 0.12 -0.21 0.00 0.06 0.00 0.00 31.60 32.84 3hyh h MET 286 CO 0.04 1.16 0.74 1.28 1.06 0.00 0.00 176.91 181.19 3hyh n LEU 287 N -3.48 6.97 -4.67 1.22 4.77 -0.46 -4.19 117.00 117.16 3hyh n LEU 287 Ca -0.06 -4.43 -0.35 0.00 -0.03 0.00 0.00 56.01 51.13 3hyh n LEU 287 Cb 1.00 -1.17 -0.09 0.00 -2.33 0.00 0.00 43.42 40.83 3hyh n LEU 287 CO 0.52 1.76 -0.22 -0.63 -1.33 0.00 0.00 177.39 177.49 3hyh s ILE 288 N -3.40 5.05 0.14 -0.08 1.01 -1.26 -4.92 121.20 117.74 3hyh s ILE 288 Ca 0.56 0.06 -0.17 0.00 0.00 0.00 0.00 60.65 61.10 3hyh s ILE 288 Cb 0.40 -3.30 -0.01 0.00 0.01 0.00 0.00 42.46 39.56 3hyh s ILE 288 CO -0.30 0.44 1.75 0.58 0.00 0.00 0.00 174.94 177.42 3hyh h VAL 289 N 4.83 1.14 -2.96 2.92 2.07 -1.92 -3.41 116.25 118.92 3hyh h VAL 289 Ca -0.38 -0.34 -0.57 0.00 0.82 0.00 0.00 66.70 66.23 3hyh h VAL 289 Cb 1.16 0.68 -0.05 0.00 -1.52 0.00 0.00 31.29 31.57 3hyh h VAL 289 CO 0.72 0.14 0.87 0.21 0.02 0.00 0.00 177.57 179.53 3hyh s ASN 290 N -5.64 6.99 0.56 0.57 2.47 -1.26 -4.73 114.94 113.89 3hyh s ASN 290 Ca -0.13 1.61 0.29 0.00 0.42 0.00 0.00 52.86 55.05 3hyh s ASN 290 Cb 0.10 -2.54 1.65 0.00 -1.45 0.00 0.00 41.25 39.01 3hyh s ASN 290 CO 0.73 -0.74 2.16 -0.65 -3.72 0.00 0.00 177.10 174.88 3hyh h PRO 291 N 8.00 0.00 -0.01 0.43 0.11 -1.96 -2.06 132.00 136.52 3hyh h PRO 291 Ca -0.25 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 65.76 3hyh h PRO 291 Cb 1.09 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.19 3hyh h PRO 291 CO 0.97 0.07 -0.51 -0.07 -0.21 0.00 0.00 178.00 178.24 3hyh h LEU 292 N 0.00 0.02 -1.40 2.35 4.07 -1.94 -3.09 115.31 115.32 3hyh h LEU 292 Ca -0.00 -0.01 0.00 0.00 0.08 0.00 0.00 57.88 57.95 3hyh h LEU 292 Cb 0.19 -0.01 0.00 0.00 1.08 0.00 0.00 40.66 41.92 3hyh h LEU 292 CO 0.01 0.53 -0.15 0.59 -1.08 0.00 0.00 178.44 178.33 3hyh n ASN 293 N -3.93 2.33 -4.70 -0.43 3.02 -0.79 -4.95 115.26 105.81 3hyh n ASN 293 Ca -0.01 -1.70 -0.42 0.00 -0.03 0.00 0.00 54.58 52.42 3hyh n ASN 293 Cb 0.53 0.14 -0.03 0.00 -0.61 0.00 0.00 39.78 39.81 3hyh n ASN 293 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 3hyh s ARG 294 N -2.17 4.53 0.25 3.52 3.52 -1.10 -4.97 118.95 122.53 3hyh s ARG 294 Ca 0.27 1.40 -0.29 0.00 -0.13 0.00 0.00 55.73 56.98 3hyh s ARG 294 Cb 0.20 -3.48 -0.15 0.00 -1.56 0.00 0.00 34.95 29.96 3hyh s ARG 294 CO 0.40 -0.11 0.94 1.51 -0.81 0.00 0.00 175.30 177.23 3hyh n ILE 295 N 4.04 1.80 -2.41 4.11 3.06 -1.02 -4.98 119.36 123.96 3hyh n ILE 295 Ca 0.06 -0.45 -0.26 0.00 -2.50 0.00 0.00 62.75 59.61 3hyh n ILE 295 Cb 0.51 -0.77 0.04 0.00 0.54 0.00 0.00 39.64 39.95 3hyh n ILE 295 CO 0.00 0.00 0.00 -0.94 -2.50 0.00 0.00 176.55 173.11 3hyh s SER 296 N -0.55 5.37 0.10 9.51 1.04 -1.26 -4.91 113.70 123.01 3hyh s SER 296 Ca 0.62 0.54 -0.20 0.00 0.48 0.00 0.00 55.95 57.40 3hyh s SER 296 Cb -0.78 -1.45 -0.07 0.00 0.10 0.00 0.00 66.02 63.82 3hyh s SER 296 CO 0.58 -1.19 1.68 0.40 0.98 0.00 0.00 173.24 175.69 3hyh h ILE 297 N -0.22 1.13 -0.28 -1.02 2.04 -1.95 -0.75 117.51 116.47 3hyh h ILE 297 Ca -0.45 -0.37 -0.02 0.00 1.00 0.00 0.00 64.86 65.02 3hyh h ILE 297 Cb 1.28 0.98 -0.01 0.00 -0.74 0.00 0.00 36.82 38.32 3hyh h ILE 297 CO 0.59 0.13 0.09 0.45 0.00 0.00 0.00 178.15 179.42 3hyh h HIS 298 N 0.23 0.38 -0.12 1.37 3.86 -1.99 -1.13 115.15 117.75 3hyh h HIS 298 Ca 0.07 -0.01 -0.15 0.00 -1.16 0.00 0.00 60.37 59.12 3hyh h HIS 298 Cb 0.11 -0.12 -0.01 0.00 1.06 0.00 0.00 27.41 28.45 3hyh h HIS 298 CO -0.03 0.32 -0.58 0.93 0.86 0.00 0.00 177.93 179.43 3hyh h GLU 299 N 0.39 0.39 -0.45 2.45 5.08 -1.91 -2.86 114.58 117.67 3hyh h GLU 299 Ca 0.10 -0.25 -0.00 0.00 -1.00 0.00 0.00 59.36 58.20 3hyh h GLU 299 Cb 0.11 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.37 3hyh h GLU 299 CO -0.01 0.86 0.26 0.82 -1.00 0.00 0.00 179.01 179.94 3hyh h ILE 300 N 0.29 1.15 0.00 3.13 2.04 -0.09 -2.60 117.51 121.43 3hyh h ILE 300 Ca -0.00 -0.34 0.00 0.00 1.00 0.00 0.00 64.86 65.52 3hyh h ILE 300 Cb 1.10 0.56 0.00 0.00 -0.74 0.00 0.00 36.82 37.74 3hyh h ILE 300 CO 0.10 0.15 0.00 0.24 0.00 0.00 0.00 178.15 178.64 3hyh h MET 301 N 0.59 0.00 0.00 2.37 2.86 -1.22 -0.74 114.93 118.80 3hyh h MET 301 Ca 0.16 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.80 3hyh h MET 301 Cb 0.01 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.67 3hyh h MET 301 CO -0.03 0.00 -0.42 1.04 1.06 0.00 0.00 176.91 178.56 3hyh n GLN 302 N -2.80 0.25 -2.25 1.72 6.02 -1.01 -4.69 117.38 114.62 3hyh n GLN 302 Ca -0.00 0.11 -0.41 0.00 -0.01 0.00 0.00 57.00 56.69 3hyh n GLN 302 Cb 0.19 -1.69 -0.03 0.00 1.02 0.00 0.00 30.24 29.73 3hyh n GLN 302 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 3hyh s ASP 303 N -4.15 6.95 0.17 1.08 -1.08 -0.28 -4.89 116.67 114.47 3hyh s ASP 303 Ca 0.08 2.51 -0.14 0.00 -0.52 0.00 0.00 52.55 54.47 3hyh s ASP 303 Cb 0.14 -2.64 0.07 0.00 -1.46 0.00 0.00 42.92 39.03 3hyh s ASP 303 CO 0.68 -0.41 1.82 0.44 0.52 0.00 0.00 175.17 178.22 3hyh h ASP 304 N 3.88 0.52 -0.98 -0.34 3.45 -1.93 -0.97 116.42 120.05 3hyh h ASP 304 Ca -0.47 -0.00 0.04 0.00 0.43 0.00 0.00 57.03 57.02 3hyh h ASP 304 Cb 1.22 -0.12 -0.06 0.00 -0.56 0.00 0.00 39.33 39.81 3hyh h ASP 304 CO 0.68 0.37 0.64 -0.25 -1.57 0.00 0.00 179.24 179.11 3hyh h TRP 305 N 0.63 1.19 -0.32 4.55 7.01 -1.92 -2.93 115.95 124.16 3hyh h TRP 305 Ca 0.19 0.03 -0.12 0.00 2.11 0.00 0.00 58.89 61.10 3hyh h TRP 305 Cb -0.03 -0.40 -0.01 0.00 -2.10 0.00 0.00 29.16 26.63 3hyh h TRP 305 CO -0.05 0.67 -0.27 0.35 -2.79 0.00 0.00 178.44 176.35 3hyh h PHE 306 N 1.21 0.88 0.00 2.65 3.57 -1.67 -3.23 116.94 120.36 3hyh h PHE 306 Ca 0.40 -0.25 0.00 0.00 3.53 0.00 0.00 57.97 61.65 3hyh h PHE 306 Cb 0.05 -0.19 0.00 0.00 2.79 0.00 0.00 35.95 38.60 3hyh h PHE 306 CO -0.01 1.00 0.00 0.87 -2.23 0.00 0.00 178.31 177.95 3hyh h LYS 307 N 0.50 0.00 -6.34 1.11 1.57 -1.02 -3.42 116.57 108.98 3hyh h LYS 307 Ca 0.06 0.00 -0.59 0.00 -1.87 0.00 0.00 60.65 58.25 3hyh h LYS 307 Cb 0.83 0.00 0.03 0.00 0.08 0.00 0.00 32.23 33.17 3hyh h LYS 307 CO 0.07 0.00 1.08 0.28 -0.57 0.00 0.00 179.45 180.31 3hyh n VAL 308 N -2.63 0.51 -2.17 0.50 0.31 -1.19 -1.79 118.33 111.88 3hyh n VAL 308 Ca 0.01 -0.09 -0.13 0.00 -0.01 0.00 0.00 64.34 64.12 3hyh n VAL 308 Cb 0.25 -1.92 -0.02 0.00 -0.91 0.00 0.00 33.84 31.25 3hyh n VAL 308 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 3hyh n ASP 309 N 6.24 -3.84 -4.63 4.52 8.00 -1.26 -4.91 116.55 120.67 3hyh n ASP 309 Ca 0.21 0.22 -0.43 0.00 0.71 0.00 0.00 54.79 55.50 3hyh n ASP 309 Cb 0.32 -3.34 -0.03 0.00 -0.02 0.00 0.00 41.12 38.05 3hyh n ASP 309 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 3hyh s LEU 310 N -5.14 3.93 0.28 0.64 2.96 -0.74 -4.96 118.68 115.65 3hyh s LEU 310 Ca 0.00 1.97 -0.29 0.00 -0.22 0.00 0.00 54.13 55.59 3hyh s LEU 310 Cb 0.00 -3.53 -0.10 0.00 0.50 0.00 0.00 46.19 43.07 3hyh s LEU 310 CO 0.00 -1.37 1.31 -2.84 -1.32 0.00 0.00 176.35 172.12 3hyh s PRO 311 N 5.03 4.38 0.39 0.98 0.02 -1.26 -4.91 135.00 139.63 3hyh s PRO 311 Ca 0.83 2.14 0.09 0.00 0.02 0.00 0.00 61.00 64.09 3hyh s PRO 311 Cb -0.32 -3.12 0.81 0.00 0.02 0.00 0.00 34.50 31.89 3hyh s PRO 311 CO 0.34 -0.20 1.94 0.93 -0.33 0.00 0.00 177.00 179.69 3hyh h GLU 312 N 4.19 0.28 0.00 5.54 3.07 -2.02 -2.73 114.58 122.91 3hyh h GLU 312 Ca -0.47 -0.05 -0.00 0.00 -0.50 0.00 0.00 59.36 58.33 3hyh h GLU 312 Cb 1.22 -0.04 -0.00 0.00 -0.84 0.00 0.00 28.75 29.09 3hyh h GLU 312 CO 0.70 0.36 -0.00 0.10 -1.40 0.00 0.00 179.01 178.77 3hyh h TYR 313 N 0.27 0.00 -0.00 4.33 -0.00 -2.03 -1.77 116.97 117.77 3hyh h TYR 313 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.79 3hyh h TYR 313 Cb 0.30 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.03 3hyh h TYR 313 CO 0.01 0.00 -0.12 1.28 -0.00 0.00 0.00 178.16 179.32 3hyh n LEU 314 N -3.31 0.16 -0.01 0.10 4.77 -1.03 -5.06 117.00 112.62 3hyh n LEU 314 Ca -0.03 0.31 0.16 0.00 -0.03 0.00 0.00 56.01 56.43 3hyh n LEU 314 Cb 0.08 -0.39 0.94 0.00 -2.33 0.00 0.00 43.42 41.72 3hyh n LEU 314 CO 0.23 0.04 1.10 0.18 -1.33 0.00 0.00 177.39 177.61